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Large ribosomal subunit protein uL3

Component of the large ribosomal subunit^1,2,3,4. The ribosome is a large ribonucleoprotein complex responsible for the synthesis of proteins in the cell^5,6,7.

AlphaFold DB , UniProt , Accession P39023, Species HUMAN (Homo sapiens, Human), Gene RPL3, Length 403 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	60	Low	91	Very high	234 Å²	234	134.3 Å²	134.3	100%	1.153	68%	0.683	S	S	*	*				0	120.6	0	-71.9	-173.3	-157.4	0	0	107.4
2	S	87.4	Confident	91.4	Very high	102 Å²	102	125.5 Å²	125.5	71%	0.713	65%	0.651	S	S	*	*			trans	-67.5	-178.7	169.6	-169.2	0	0	0	0	110.3
3	H	91.6	Very high	91.8	Very high	158 Å²	158	120.7 Å²	120.7	73%	0.731	64%	0.635	S	S	*	*	S	Bend	trans	-50.7	160	172	66.7	-83.3	0	0	0	111.8	K5	H3-K5 PolarHBondContact O-N 3.43Å
4	R	92.1	Very high	92.2	Very high	163 Å²	163	116.3 Å²	116.3	62%	0.615	61%	0.612	S	S	*	*			trans	-62.1	121.4	-179.5	-174	-176.5	175.7	-169.9	-8.9	110.2	F6 A8	R4-F6 WeakPolarHBondContact CD-O 3.45Å; R4-F6 VanDerWaalsContact CG-O 3.29Å; R4-F6 WeakPolarHBondContact CG-O 3.31Å; R4-F6 PolarHBondContact NE-O 3.22Å; R4-F6 PolarHBondContact O-N 2.93Å; R4-F6 VanDerWaalsContact O-N 3.11Å; R4-A8 VanDerWaalsContact NH2-CB 3.29Å
5	K	94.7	Very high	92.6	Very high	179 Å²	179	113.3 Å²	113.3	78%	0.778	62%	0.62	S	S	*	*	S	Bend	trans	-50.6	-36.9	-179.5	-174.2	173.8	-178.9	171.7	0	114.6	H3	H3-K5 PolarHBondContact O-N 3.43Å
6	F	96	Very high	92.9	Very high	150 Å²	150	112.6 Å²	112.6	66%	0.658	61%	0.609	S	S	*	*	S	Bend	trans	-131.5	128	177.9	-60.9	-74	0	0	0	111.2	R4	R4-F6 WeakPolarHBondContact CD-O 3.45Å; R4-F6 VanDerWaalsContact CG-O 3.29Å; R4-F6 WeakPolarHBondContact CG-O 3.31Å; R4-F6 PolarHBondContact NE-O 3.22Å; R4-F6 PolarHBondContact O-N 2.93Å; R4-F6 VanDerWaalsContact O-N 3.11Å
7	S	95.1	Very high	93.2	Very high	122 Å²	122	109.4 Å²	109.4	85%	0.853	59%	0.591	S	S	*	*			trans	-70.6	144.3	174.4	-69.3	0	0	0	0	111.6
8	A	95.1	Very high	93.4	Very high	49 Å²	49	108.6 Å²	108.6	41%	0.405	59%	0.593	S	S	.	*			trans	-149.5	150.8	167.9	0	0	0	0	0	109.6	R4	R4-A8 VanDerWaalsContact NH2-CB 3.29Å
9	P	97.1	Very high	93.6	Very high	120 Å²	120	104.9 Å²	104.9	78%	0.779	57%	0.569	S	S	*	*			trans	-56.8	149.1	174.4	-24.2	33.9	0	0	0	112
10	R	95.6	Very high	93.8	Very high	114 Å²	114	107 Å²	107	43%	0.43	57%	0.572	S	S	.	*			trans	-65.9	137.4	177.1	178.1	179.3	165.2	66.2	27.8	111.4	G12 S265	R10-G12 PolarHBondContact O-N 3.06Å; R10-G12 VanDerWaalsContact O-N 3.16Å; R10-S265 PolarHBondContact NH1-O 2.97Å; R10-S265 PolarHBondContact NH2-O 2.95Å
11	H	96.8	Very high	94.1	Very high	86 Å²	86	109.6 Å²	109.6	40%	0.398	57%	0.574	S	S	.	*	S	Bend	trans	-72.8	108.3	174.4	-69.5	-69.7	0	0	0	112.4	H236 T237	H11-H236 PolarHBondContact CE1-O 3.46Å; H11-H236 PolarHBondContact ND1-O 3.02Å; H11-H236 VanDerWaalsContact ND1-O 3.14Å; H11-T237 HydrophobicContact CB-CG2 4.23Å
12	G	95.4	Very high	95.9	Very high	29 Å²	29	99.4 Å²	99.4	30%	0.299	53%	0.526	S	S	.	.	S	Bend	trans	80.6	136.2	170	0	0	0	0	0	114.8	R10	R10-G12 PolarHBondContact O-N 3.06Å; R10-G12 VanDerWaalsContact O-N 3.16Å
13	S	97.1	Very high	96.3	Very high	63 Å²	63	100.5 Å²	100.5	44%	0.441	53%	0.534	S	S	.	.			trans	-63.4	135.8	178.3	167.1	0	0	0	0	112.5	G15 R19	S13-G15 PolarHBondContact OG-N 3.16Å; S13-R19 PolarHBondContact O-NH2 3.25Å
14	L	97.6	Very high	96.5	Very high	59 Å²	59	98.7 Å²	98.7	31%	0.309	52%	0.52	S	S	.	.	S	Bend	trans	-82.4	-24.1	175.2	-69.1	179.2	0	0	0	113	F16 L17	L14-F16 PolarHBondContact O-N 2.87Å; L14-L17 HydrophobicContact CD2-CD1 3.64Å; L14-L17 HydrophobicContact CD2-CG 4.35Å; L14-L17 WeakPolarHBondContact O-CB 3.44Å; L14-L17 PolarHBondContact O-N 3.1Å
15	G	97.6	Very high	96.5	Very high	71 Å²	71	94.9 Å²	94.9	73%	0.732	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-8.5	176.9	0	0	0	0	0	114.2	S13	S13-G15 PolarHBondContact OG-N 3.16Å
16	F	97.3	Very high	96.6	Very high	102 Å²	102	88 Å²	88	45%	0.447	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	12.7	173.5	-67.5	-64.5	0	0	0	113.9	L14 P18 R19 R277	L14-F16 PolarHBondContact O-N 2.87Å; F16-P18 CarbonylContact O-C 3.59Å; F16-R19 WeakPolarHBondContact O-CG 3.41Å; F16-R277 VanDerWaalsContact CD1-CZ 3.46Å
17	L	97.5	Very high	96.6	Very high	58 Å²	58	80.9 Å²	80.9	30%	0.304	45%	0.447	S	S	.	.			trans	-74.6	147.2	161.1	-69.6	-179.9	0	0	0	109.8	L14 R19 W235 F264	L14-L17 HydrophobicContact CD2-CD1 3.64Å; L14-L17 HydrophobicContact CD2-CG 4.35Å; L14-L17 WeakPolarHBondContact O-CB 3.44Å; L14-L17 PolarHBondContact O-N 3.1Å; L17-R19 HydrophobicContact CD2-CG 4.17Å; L17-W235 HydrophobicContact CD2-CH2 3.86Å; L17-W235 HydrophobicContact CD2-CZ2 4.16Å; L17-W235 HydrophobicContact CG-CH2 4.49Å; L17-F264 HydrophobicContact CD1-CD2 3.8Å; L17-F264 HydrophobicContact CD1-CE2 4.3Å
18	P	97.6	Very high	96.7	Very high	96 Å²	96	79.8 Å²	79.8	62%	0.623	43%	0.427	S	S	*	.	S	Bend	cis	-73.8	135.7	-7.1	29.3	-34	0	0	0	112.8	F16 K20	F16-P18 CarbonylContact O-C 3.59Å; P18-K20 VanDerWaalsContact C-N 3.27Å; P18-K20 HydrophobicContact CB-CD 4.48Å; P18-K20 HydrophobicContact CB-CG 4.39Å; P18-K20 HydrophobicContact CG-CD 4.32Å; P18-K20 HydrophobicContact CG-CG 4.38Å; P18-K20 PolarHBondContact O-N 3.13Å
19	R	97.5	Very high	96.8	Very high	39 Å²	39	78 Å²	78	15%	0.147	41%	0.412	C	S	.	.			trans	-83.6	65.7	175	-72.2	177.2	-177.6	-123.5	-3.1	111.5	S13 F16 L17 R234	S13-R19 PolarHBondContact O-NH2 3.25Å; F16-R19 WeakPolarHBondContact O-CG 3.41Å; L17-R19 HydrophobicContact CD2-CG 4.17Å; R19-R234 PolarHBondContact NH1-O 3Å; R19-R234 PolarHBondContact O-NH2 2.88Å
20	K	97.8	Very high	96.9	Very high	145 Å²	145	80 Å²	80	63%	0.63	41%	0.408	S	S	*	.			trans	-112.8	167.5	179	69.9	179.1	-170.4	-178.4	0	112.3	P18 S22 H275	P18-K20 VanDerWaalsContact C-N 3.27Å; P18-K20 HydrophobicContact CB-CD 4.48Å; P18-K20 HydrophobicContact CB-CG 4.39Å; P18-K20 HydrophobicContact CG-CD 4.32Å; P18-K20 HydrophobicContact CG-CG 4.38Å; P18-K20 PolarHBondContact O-N 3.13Å; K20-S22 PolarHBondContact O-N 3.02Å; K20-H275 PolarHBondContact O-CD2 3.45Å
21	R	98.4	Very high	97	Very high	163 Å²	163	77.8 Å²	77.8	62%	0.615	41%	0.41	S	S	*	.			trans	-58.7	135.2	171.8	-71.8	179.3	67.9	174.2	-1.2	109.8	S23 Q271 Y274	R21-S23 PolarHBondContact O-N 3.35Å; R21-Q271 HydrophobicContact CG-CG 3.87Å; R21-Y274 CarbonylContact C-O 3.57Å; R21-Y274 HydrophobicContact CB-CD1 3.85Å; R21-Y274 HydrophobicContact CG-CD1 4.08Å
22	S	97.8	Very high	97	Very high	19 Å²	19	74.9 Å²	74.9	13%	0.133	40%	0.396	C	S	.	.			trans	-59.7	132.7	170.9	-178.3	0	0	0	0	109.6	K20 R24 Y274	K20-S22 PolarHBondContact O-N 3.02Å; S22-R24 VanDerWaalsContact C-N 3.28Å; S22-R24 WeakPolarHBondContact CB-O 3.46Å; S22-R24 PolarHBondContact O-N 3.28Å; S22-R24 PolarHBondContact OG-N 2.99Å; S22-R24 PolarHBondContact OG-O 2.93Å; S22-Y274 WeakPolarHBondContact CB-O 3.32Å; S22-Y274 PolarHBondContact N-O 3.45Å; S22-Y274 WeakPolarHBondContact O-CE1 3.3Å
23	S	96.7	Very high	97.1	Very high	126 Å²	126	74.3 Å²	74.3	88%	0.881	39%	0.387	S	S	*	.	S	Bend	trans	-68.8	-28.8	176	54.4	0	0	0	0	112.5	R21	R21-S23 PolarHBondContact O-N 3.35Å
24	R	94.9	Very high	97.1	Very high	119 Å²	119	81 Å²	81	45%	0.449	41%	0.408	S	S	.	.	S	Bend	trans	-106.1	141	175.9	-62.9	-178.7	-179.1	-160.8	-1.9	109.9	S22 R26 V222	S22-R24 VanDerWaalsContact C-N 3.28Å; S22-R24 WeakPolarHBondContact CB-O 3.46Å; S22-R24 PolarHBondContact O-N 3.28Å; S22-R24 PolarHBondContact OG-N 2.99Å; S22-R24 PolarHBondContact OG-O 2.93Å; R24-R26 WeakPolarHBondContact CB-O 3.34Å; R24-V222 WeakPolarHBondContact O-CG2 3.39Å
25	H	94	Very high	97	Very high	83 Å²	83	80.8 Å²	80.8	38%	0.384	41%	0.408	S	S	.	.	S	Bend	trans	-68.8	-37.8	172.3	-172.3	72.3	0	0	0	112	V222 Y274	H25-V222 WeakPolarHBondContact O-CG2 3.36Å; H25-Y274 PolarHBondContact ND1-OH 2.96Å; H25-Y274 VanDerWaalsContact ND1-OH 3.15Å
26	R	95.8	Very high	97	Very high	36 Å²	36	80 Å²	80	14%	0.136	39%	0.386	C	S	.	.	S	Bend	trans	-83.7	147.1	173.7	-172.6	-173.3	68.6	-143.8	-0.2	111.6	R24 K28 L47 L180 M181 V344 T346	R24-R26 WeakPolarHBondContact CB-O 3.34Å; R26-K28 PolarHBondContact O-N 3.11Å; R26-L47 HydrophobicContact CG-CD2 4.43Å; R26-L180 PolarHBondContact NH1-O 3.13Å; R26-L180 PolarHBondContact NH2-O 2.92Å; R26-M181 VanDerWaalsContact CZ-CB 3.5Å; R26-V344 HydrophobicContact CB-CG1 3.82Å; R26-V344 HydrophobicContact CG-CG1 3.93Å; R26-V344 HydrophobicContact CG-CG2 4.17Å; R26-T346 WeakPolarHBondContact CG-OG1 3.36Å
27	G	96.2	Very high	96.9	Very high	0 Å²	0	79.1 Å²	79.1	0%	0	39%	0.391	C	S	.	.			trans	-59.7	113.7	163.1	0	0	0	0	0	112.5	T346	G27-T346 PolarHBondContact O-OG1 3.27Å
28	K	97.6	Very high	96.9	Very high	98 Å²	98	81.2 Å²	81.2	43%	0.426	41%	0.411	S	S	.	.			trans	-75.4	131.9	169.6	-174.1	-174	-179	-178.6	0	109	R26 K30 H276	R26-K28 PolarHBondContact O-N 3.11Å; K28-K30 PolarHBondContact O-N 2.92Å; K28-H276 PolarHBondContact N-NE2 3.1Å; K28-H276 PolarHBondContact O-NE2 3.36Å
29	V	97.8	Very high	96.8	Very high	13 Å²	13	81.8 Å²	81.8	8%	0.079	40%	0.403	C	S	.	.			trans	-70	111.4	163.9	-171.1	0	0	0	0	107.9	S31 F32 A45 M181 I220 T346 R348	V29-S31 WeakPolarHBondContact CG1-O 3.49Å; V29-F32 HydrophobicContact CB-CD1 4.48Å; V29-F32 HydrophobicContact CB-CE1 3.89Å; V29-F32 HydrophobicContact CB-CE2 4.03Å; V29-F32 HydrophobicContact CB-CZ 3.64Å; V29-F32 HydrophobicContact CG1-CD1 3.68Å; V29-F32 HydrophobicContact CG1-CD2 3.97Å; V29-F32 HydrophobicContact CG1-CE1 3.59Å; V29-F32 HydrophobicContact CG1-CE2 3.87Å; V29-F32 HydrophobicContact CG1-CG 3.89Å; V29-F32 HydrophobicContact CG1-CZ 3.69Å; V29-F32 HydrophobicContact CG2-CE1 3.99Å; V29-F32 HydrophobicContact CG2-CZ 4.03Å; V29-A45 HydrophobicContact CG2-CB 4.47Å; V29-M181 HydrophobicContact CG2-CE 3.88Å; V29-I220 HydrophobicContact CB-CD1 4.38Å; V29-I220 HydrophobicContact CG1-CD1 4.3Å; V29-I220 HydrophobicContact CG2-CD1 4.15Å; V29-T346 HydrophobicContact CG2-CG2 3.46Å; V29-T346 VanDerWaalsContact CG2-CG2 3.46Å; V29-R348 HydrophobicContact CG1-CG 4.37Å
30	K	97.3	Very high	96.8	Very high	161 Å²	161	85.1 Å²	85.1	70%	0.7	43%	0.43	S	S	*	.	S	Bend	trans	-87.7	-25	179	-66	-175	-179.9	-177.2	0	112.7	K28	K28-K30 PolarHBondContact O-N 2.92Å
31	S	97.7	Very high	96.8	Very high	68 Å²	68	79.5 Å²	79.5	48%	0.476	41%	0.408	S	S	.	.	S	Bend	trans	-143.4	130.7	178.9	-48.1	0	0	0	0	107.1	V29 R348	V29-S31 WeakPolarHBondContact CG1-O 3.49Å; S31-R348 WeakPolarHBondContact O-CD 3.36Å; S31-R348 PolarHBondContact O-NH1 3.45Å
32	F	98	Very high	96.8	Very high	24 Å²	24	74 Å²	74	11%	0.105	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-92.3	164	170.9	-73.1	-83.7	0	0	0	109.6	V29 T44 A45 E182 Q184 L351	V29-F32 HydrophobicContact CB-CD1 4.48Å; V29-F32 HydrophobicContact CB-CE1 3.89Å; V29-F32 HydrophobicContact CB-CE2 4.03Å; V29-F32 HydrophobicContact CB-CZ 3.64Å; V29-F32 HydrophobicContact CG1-CD1 3.68Å; V29-F32 HydrophobicContact CG1-CD2 3.97Å; V29-F32 HydrophobicContact CG1-CE1 3.59Å; V29-F32 HydrophobicContact CG1-CE2 3.87Å; V29-F32 HydrophobicContact CG1-CG 3.89Å; V29-F32 HydrophobicContact CG1-CZ 3.69Å; V29-F32 HydrophobicContact CG2-CE1 3.99Å; V29-F32 HydrophobicContact CG2-CZ 4.03Å; F32-T44 VanDerWaalsContact CD1-OG1 3.23Å; F32-T44 WeakPolarHBondContact CD1-OG1 3.38Å; F32-A45 HydrophobicContact CE1-CB 4.1Å; F32-E182 WeakPolarHBondContact CZ-O 3.4Å; F32-Q184 HydrophobicContact CB-CB 3.89Å; F32-Q184 HydrophobicContact CB-CG 4.44Å; F32-Q184 HydrophobicContact CD1-CB 3.71Å; F32-Q184 HydrophobicContact CD2-CB 3.81Å; F32-Q184 HydrophobicContact CE1-CB 4.14Å; F32-Q184 HydrophobicContact CE2-CB 4.24Å; F32-Q184 HydrophobicContact CG-CB 3.52Å; F32-Q184 HydrophobicContact CG-CG 4.48Å; F32-Q184 HydrophobicContact CZ-CB 4.38Å; F32-L351 VanDerWaalsContact C-CD2 3.41Å; F32-L351 VanDerWaalsContact O-CD2 3.28Å; F32-L351 WeakPolarHBondContact O-CD2 3.43Å
33	P	97.6	Very high	96.8	Very high	17 Å²	17	73.4 Å²	73.4	11%	0.11	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-51.8	146.2	168.9	-23.2	33.5	0	0	0	110.9	D35 T44 N186 K349 L351	P33-D35 PolarHBondContact O-N 3.21Å; P33-T44 HydrophobicContact CG-CG2 4.24Å; P33-N186 PolarHBondContact O-ND2 2.85Å; P33-K349 HydrophobicContact CG-CB 3.85Å; P33-L351 HydrophobicContact CG-CD2 4.39Å
34	K	96.1	Very high	96.9	Very high	203 Å²	203	67.4 Å²	67.4	88%	0.883	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-58.3	138.7	173.5	-70.4	-172.1	176.5	-173.7	0	108.9	N186	K34-N186 PolarHBondContact O-ND2 3.07Å
35	D	97	Very high	97.1	Very high	56 Å²	56	61.7 Å²	61.7	30%	0.299	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-77.1	143	178.9	-166.4	13.6	0	0	0	109.9	P33 N186 G187 K193	P33-D35 PolarHBondContact O-N 3.21Å; D35-N186 VanDerWaalsContact OD1-CA 3.24Å; D35-N186 WeakPolarHBondContact OD1-CA 3.21Å; D35-N186 WeakPolarHBondContact OD1-CB 3.43Å; D35-G187 PolarHBondContact OD1-N 3.21Å; D35-K193 IonicContact OD1-NZ 2.9Å; D35-K193 PolarHBondContact OD1-NZ 2.67Å; D35-K193 WeakPolarHBondContact OD2-CE 3.32Å; D35-K193 IonicContact OD2-NZ 2.88Å; D35-K193 PolarHBondContact OD2-NZ 2.55Å
36	D	96.1	Very high	97.3	Very high	53 Å²	53	57.8 Å²	57.8	28%	0.283	30%	0.303	S	S	.	.			trans	-138.4	97.6	-178	177.8	-2.2	0	0	0	107.5	S38 K39 G187	D36-S38 VanDerWaalsContact CG-OG 3.32Å; D36-S38 PolarHBondContact O-N 3.24Å; D36-S38 VanDerWaalsContact O-N 3.11Å; D36-S38 WeakPolarHBondContact OD1-CB 3.35Å; D36-S38 PolarHBondContact OD1-N 3.45Å; D36-S38 PolarHBondContact OD1-OG 3.5Å; D36-S38 PolarHBondContact OD2-OG 2.98Å; D36-K39 HydrophobicContact CB-CD 4.3Å; D36-K39 HydrophobicContact CB-CG 4.39Å; D36-K39 PolarHBondContact O-N 2.98Å; D36-K39 VanDerWaalsContact O-N 3.14Å; D36-K39 IonicContact OD2-NZ 2.78Å; D36-K39 PolarHBondContact OD2-NZ 3.44Å; D36-G187 WeakPolarHBondContact O-CA 3.41Å
37	P	96.1	Very high	97.5	Very high	84 Å²	84	56.1 Å²	56.1	55%	0.545	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.9	-175.2	-25.6	35.2	0	0	0	114.6	K39 G188	P37-K39 PolarHBondContact O-N 2.99Å; P37-G188 WeakPolarHBondContact O-CA 3.36Å; P37-G188 PolarHBondContact O-N 2.95Å
38	S	97	Very high	97.6	Very high	103 Å²	103	56.1 Å²	56.1	72%	0.72	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-18	178.5	71	0	0	0	0	113.7	D36	D36-S38 VanDerWaalsContact CG-OG 3.32Å; D36-S38 PolarHBondContact O-N 3.24Å; D36-S38 VanDerWaalsContact O-N 3.11Å; D36-S38 WeakPolarHBondContact OD1-CB 3.35Å; D36-S38 PolarHBondContact OD1-N 3.45Å; D36-S38 PolarHBondContact OD1-OG 3.5Å; D36-S38 PolarHBondContact OD2-OG 2.98Å
39	K	96.4	Very high	97.6	Very high	107 Å²	107	51.5 Å²	51.5	47%	0.465	28%	0.276	S	S	.	.	S	Bend	trans	-86.4	153.1	179.6	-70.8	-175.2	173.9	104.1	0	111.4	D36 P37 G187 G188	D36-K39 HydrophobicContact CB-CD 4.3Å; D36-K39 HydrophobicContact CB-CG 4.39Å; D36-K39 PolarHBondContact O-N 2.98Å; D36-K39 VanDerWaalsContact O-N 3.14Å; D36-K39 IonicContact OD2-NZ 2.78Å; D36-K39 PolarHBondContact OD2-NZ 3.44Å; P37-K39 PolarHBondContact O-N 2.99Å; K39-G187 CarbonylContact O-C 3.54Å; K39-G187 VanDerWaalsContact O-C 3.28Å; K39-G187 WeakPolarHBondContact O-CA 3.38Å; K39-G188 PolarHBondContact O-N 3.28Å
40	P	97.2	Very high	97.6	Very high	109 Å²	109	51.8 Å²	51.8	71%	0.708	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-59.9	150	171.9	26.2	-35.2	0	0	0	111.4	H42	P40-H42 PolarHBondContact O-N 2.97Å; P40-H42 PolarHBondContact O-ND1 3.26Å
41	V	98	Very high	97.7	Very high	28 Å²	28	44.1 Å²	44.1	17%	0.17	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-61.1	125.7	179.4	-172.3	0	0	0	0	110.6	V185 N186 G187 E192 K193 W196	V41-V185 HydrophobicContact CG1-CG1 3.28Å; V41-N186 CarbonylContact C-O 3.58Å; V41-N186 WeakPolarHBondContact CA-O 3.49Å; V41-G187 WeakPolarHBondContact CG2-O 3.35Å; V41-E192 HydrophobicContact CG2-CB 4.04Å; V41-K193 HydrophobicContact CG1-CG 4.27Å; V41-W196 HydrophobicContact CB-CB 4.3Å; V41-W196 HydrophobicContact CB-CD2 4.37Å; V41-W196 HydrophobicContact CB-CG 3.89Å; V41-W196 HydrophobicContact CG1-CB 3.74Å; V41-W196 HydrophobicContact CG1-CD2 3.59Å; V41-W196 HydrophobicContact CG1-CE3 4.13Å; V41-W196 HydrophobicContact CG1-CG 3.4Å; V41-W196 PolarHBondContact O-NE1 3.32Å
42	H	97.9	Very high	97.7	Very high	47 Å²	47	41.5 Å²	41.5	22%	0.218	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	162	-177	64.6	-78.7	0	0	0	113.4	P40 N186	P40-H42 PolarHBondContact O-N 2.97Å; P40-H42 PolarHBondContact O-ND1 3.26Å; H42-N186 PolarHBondContact N-O 3.45Å; H42-N186 PolarHBondContact ND1-O 3.48Å; H42-N186 PolarHBondContact O-N 2.88Å
43	L	98.4	Very high	97.7	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	151.3	172.6	-63.9	-178.1	0	0	0	112.3	V162 I183 V185 W196 V205 V210	L43-V162 HydrophobicContact CD2-CG2 3.55Å; L43-I183 HydrophobicContact CB-CG2 3.97Å; L43-I183 HydrophobicContact CD1-CD1 4.48Å; L43-I183 HydrophobicContact CD2-CB 4.42Å; L43-I183 HydrophobicContact CD2-CG2 3.94Å; L43-I183 HydrophobicContact CG-CG2 4.41Å; L43-V185 HydrophobicContact CD2-CG2 4.09Å; L43-W196 HydrophobicContact CD1-CH2 4.14Å; L43-W196 HydrophobicContact CD2-CH2 3.72Å; L43-W196 HydrophobicContact CD2-CZ3 3.7Å; L43-W196 HydrophobicContact CG-CH2 3.57Å; L43-W196 HydrophobicContact CG-CZ3 4.1Å; L43-V205 HydrophobicContact CD1-CG1 3.87Å; L43-V205 HydrophobicContact CD1-CG2 4.37Å; L43-V210 HydrophobicContact CB-CG1 4.1Å; L43-V210 HydrophobicContact CB-CG2 3.97Å; L43-V210 HydrophobicContact CD1-CG2 4.08Å
44	T	98.5	Very high	97.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.236	C	C	.	.			trans	-112.2	-4.8	-173.3	55.6	0	0	0	0	114.6	F32 P33 Q184 N186 R348 K349	F32-T44 VanDerWaalsContact CD1-OG1 3.23Å; F32-T44 WeakPolarHBondContact CD1-OG1 3.38Å; P33-T44 HydrophobicContact CG-CG2 4.24Å; T44-Q184 WeakPolarHBondContact CG2-O 3.5Å; T44-Q184 PolarHBondContact N-O 3.21Å; T44-Q184 PolarHBondContact OG1-O 3.24Å; T44-N186 HydrophobicContact CG2-CB 3.86Å; T44-R348 CarbonylContact O-C 3.28Å; T44-R348 WeakPolarHBondContact O-CA 3.41Å; T44-K349 PolarHBondContact O-N 3.41Å
45	A	98.7	Very high	97.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	160.2	-177.6	0	0	0	0	0	112.3	V29 F32 M181 I183 L347 R348	V29-A45 HydrophobicContact CG2-CB 4.47Å; F32-A45 HydrophobicContact CE1-CB 4.1Å; A45-M181 HydrophobicContact CB-CE 3.73Å; A45-I183 HydrophobicContact CB-CG1 4.37Å; A45-I183 HydrophobicContact CB-CG2 4.06Å; A45-I183 VanDerWaalsContact O-CD1 3.3Å; A45-I183 WeakPolarHBondContact O-CD1 3.3Å; A45-L347 CarbonylContact C-O 3.52Å; A45-L347 WeakPolarHBondContact CA-O 3.37Å; A45-L347 VanDerWaalsContact CB-O 3.24Å; A45-L347 WeakPolarHBondContact CB-O 3.4Å; A45-R348 HydrophobicContact CB-CB 4.47Å
46	F	98.8	Very high	97.9	Very high	1 Å²	1	34.2 Å²	34.2	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	161.7	178.1	-155.6	-95.5	0	0	0	110.5	T81 M84 V205 V207 V210 F211 T346 L347	F46-T81 HydrophobicContact CD1-CG2 4.01Å; F46-T81 HydrophobicContact CE1-CG2 4.11Å; F46-M84 HydrophobicContact CD1-CG 4.46Å; F46-M84 HydrophobicContact CD1-SD 4.08Å; F46-M84 HydrophobicContact CD2-CG 4.29Å; F46-M84 HydrophobicContact CD2-SD 3.82Å; F46-M84 HydrophobicContact CE1-CG 3.94Å; F46-M84 HydrophobicContact CE1-SD 4.17Å; F46-M84 HydrophobicContact CE2-CB 4.01Å; F46-M84 HydrophobicContact CE2-CG 3.8Å; F46-M84 HydrophobicContact CE2-SD 3.97Å; F46-M84 HydrophobicContact CG-SD 3.89Å; F46-M84 HydrophobicContact CZ-CB 4.1Å; F46-M84 HydrophobicContact CZ-CG 3.61Å; F46-M84 HydrophobicContact CZ-SD 4.14Å; F46-V205 WeakPolarHBondContact CE2-O 3.3Å; F46-V205 WeakPolarHBondContact CZ-O 3.38Å; F46-V207 HydrophobicContact CD1-CB 4.17Å; F46-V207 HydrophobicContact CD1-CG2 3.98Å; F46-V207 HydrophobicContact CE1-CB 4Å; F46-V207 HydrophobicContact CE1-CG2 4.31Å; F46-V207 HydrophobicContact CE2-CB 4.4Å; F46-V207 HydrophobicContact CG-CB 4.49Å; F46-V207 HydrophobicContact CG-CG2 4.16Å; F46-V207 HydrophobicContact CZ-CB 4.09Å; F46-V210 HydrophobicContact CD2-CB 4.44Å; F46-V210 HydrophobicContact CD2-CG2 3.89Å; F46-V210 HydrophobicContact CE2-CG2 4.45Å; F46-F211 HydrophobicContact CB-CD2 4.39Å; F46-F211 HydrophobicContact CB-CE2 3.62Å; F46-F211 HydrophobicContact CB-CZ 4.48Å; F46-T346 CarbonylContact O-C 3.52Å; F46-T346 WeakPolarHBondContact O-CA 3.32Å; F46-L347 HydrophobicContact CB-CB 4.5Å; F46-L347 PolarHBondContact N-O 2.9Å; F46-L347 PolarHBondContact O-N 3.38Å
47	L	98.6	Very high	98	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.5	173.1	-63.1	-173.7	0	0	0	111	R26 M84 T166 H179 M181 V344 L345 T346	R26-L47 HydrophobicContact CG-CD2 4.43Å; L47-M84 HydrophobicContact CB-CE 4.29Å; L47-M84 HydrophobicContact CB-SD 3.81Å; L47-M84 HydrophobicContact CD1-CE 4.11Å; L47-M84 HydrophobicContact CG-CE 3.92Å; L47-M84 HydrophobicContact CG-SD 4.02Å; L47-M84 PolarHBondContact N-SD 2.91Å; L47-T166 HydrophobicContact CB-CG2 3.42Å; L47-T166 VanDerWaalsContact CB-CG2 3.42Å; L47-T166 HydrophobicContact CD1-CG2 3.88Å; L47-T166 HydrophobicContact CG-CG2 4.22Å; L47-H179 HydrophobicContact CD1-CB 3.89Å; L47-M181 HydrophobicContact CD1-CB 4.28Å; L47-M181 HydrophobicContact CD1-CG 4Å; L47-M181 HydrophobicContact CD1-SD 3.99Å; L47-M181 HydrophobicContact CD2-CG 4.35Å; L47-M181 HydrophobicContact CD2-SD 3.31Å; L47-M181 WeakPolarHBondContact CD2-SD 3.43Å; L47-M181 HydrophobicContact CG-CG 4.05Å; L47-M181 HydrophobicContact CG-SD 3.39Å; L47-M181 WeakPolarHBondContact CG-SD 3.02Å; L47-V344 HydrophobicContact CB-CG2 4.34Å; L47-V344 HydrophobicContact CD1-CG2 4.41Å; L47-V344 HydrophobicContact CD2-CG2 4.31Å; L47-L345 WeakPolarHBondContact CA-O 3.36Å; L47-T346 HydrophobicContact CD2-CG2 3.91Å; L47-T346 WeakPolarHBondContact CD2-OG1 3.32Å
48	G	98.4	Very high	98.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	173	171.7	0	0	0	0	0	112.1	E80 V344 L345	G48-E80 CarbonylContact C-O 3.48Å; G48-E80 VanDerWaalsContact CA-O 3.23Å; G48-E80 WeakPolarHBondContact CA-O 3.21Å; G48-V344 CarbonylContact O-C 3.59Å; G48-V344 WeakPolarHBondContact O-CA 3.5Å; G48-L345 PolarHBondContact N-O 3.29Å; G48-L345 PolarHBondContact O-N 3.42Å
49	Y	98.6	Very high	98	Very high	1 Å²	1	26.3 Å²	26.3	0%	0.004	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.3	-178.3	-63.5	-95.1	0	0	0	109.2	A51 V79 E80 T166 M168 L171 L173 H179 R343 V344	Y49-A51 PolarHBondContact O-N 2.78Å; Y49-V79 CarbonylContact O-C 3.58Å; Y49-V79 WeakPolarHBondContact O-CA 3.22Å; Y49-E80 PolarHBondContact N-O 2.85Å; Y49-E80 PolarHBondContact O-N 3.39Å; Y49-T166 HydrophobicContact CE2-CG2 3.81Å; Y49-T166 VanDerWaalsContact OH-CB 3.28Å; Y49-T166 WeakPolarHBondContact OH-CB 3.4Å; Y49-T166 WeakPolarHBondContact OH-CG2 3.49Å; Y49-T166 PolarHBondContact OH-OG1 3.26Å; Y49-M168 HydrophobicContact CE1-CE 4.23Å; Y49-M168 HydrophobicContact CE1-SD 3.9Å; Y49-M168 PolarHBondContact OH-SD 2.66Å; Y49-L171 HydrophobicContact CD1-CD1 4.01Å; Y49-L171 HydrophobicContact CD2-CD1 3.34Å; Y49-L171 HydrophobicContact CD2-CD2 4.16Å; Y49-L171 HydrophobicContact CD2-CG 4.4Å; Y49-L171 HydrophobicContact CE1-CD1 3.97Å; Y49-L171 HydrophobicContact CE2-CD1 3.32Å; Y49-L171 HydrophobicContact CG-CD1 3.71Å; Y49-L171 HydrophobicContact CG-CD2 4.48Å; Y49-L173 HydrophobicContact CD1-CD1 3.97Å; Y49-L173 HydrophobicContact CE1-CD1 4.44Å; Y49-H179 AromaticContact CE1-CE1 3.82Å; Y49-H179 AromaticContact CE1-ND1 3.71Å; Y49-H179 AromaticContact CZ-ND1 3.65Å; Y49-H179 PolarHBondContact OH-ND1 3Å; Y49-R343 WeakPolarHBondContact CA-O 3.39Å; Y49-V344 HydrophobicContact CD1-CB 4.16Å; Y49-V344 HydrophobicContact CE1-CB 3.79Å; Y49-V344 HydrophobicContact CE1-CG2 4.19Å
50	K	98.6	Very high	98	Very high	19 Å²	19	21.3 Å²	21.3	8%	0.083	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	109.6	178.8	-172.4	173.3	-176.8	176.5	0	109.6	T77 V337 G339 K341 K342 R343 L345	K50-T77 HydrophobicContact CD-CG2 4.18Å; K50-T77 HydrophobicContact CG-CG2 3.82Å; K50-V337 HydrophobicContact CD-CG2 3.76Å; K50-V337 HydrophobicContact CG-CG2 4.37Å; K50-V337 PolarHBondContact NZ-O 3.08Å; K50-G339 PolarHBondContact NZ-O 3.49Å; K50-K341 CarbonylContact O-C 3.48Å; K50-K341 VanDerWaalsContact O-CA 3.25Å; K50-K341 WeakPolarHBondContact O-CA 3.33Å; K50-K342 PolarHBondContact O-N 3.05Å; K50-R343 PolarHBondContact N-O 2.96Å; K50-L345 HydrophobicContact CB-CD1 3.93Å; K50-L345 HydrophobicContact CB-CG 4.44Å
51	A	98.2	Very high	97.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-58.5	178.7	0	0	0	0	0	110.5	Y49 I78 F320 Y323 V326 K341	Y49-A51 PolarHBondContact O-N 2.78Å; A51-I78 HydrophobicContact CB-CB 4.49Å; A51-I78 HydrophobicContact CB-CG2 4.39Å; A51-I78 PolarHBondContact N-O 2.98Å; A51-F320 HydrophobicContact CB-CD2 4.17Å; A51-F320 HydrophobicContact CB-CG 4.47Å; A51-Y323 HydrophobicContact CB-CD1 3.66Å; A51-Y323 HydrophobicContact CB-CD2 4.28Å; A51-Y323 HydrophobicContact CB-CE1 3.57Å; A51-Y323 HydrophobicContact CB-CE2 4.19Å; A51-Y323 HydrophobicContact CB-CG 4.02Å; A51-Y323 WeakPolarHBondContact O-CB 3.33Å; A51-V326 HydrophobicContact CB-CG2 3.45Å; A51-V326 VanDerWaalsContact CB-CG2 3.45Å; A51-K341 WeakPolarHBondContact O-CB 3.41Å
52	G	97.9	Very high	97.7	Very high	13 Å²	13	21.1 Å²	21.1	13%	0.134	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	-159	-179.4	0	0	0	0	0	111.8	T77 I78	G52-T77 VanDerWaalsContact O-CG2 3.31Å; G52-T77 WeakPolarHBondContact O-CG2 3.48Å; G52-I78 PolarHBondContact O-N 3.27Å
53	M	98.5	Very high	97.5	Very high	70 Å²	70	23.4 Å²	23.4	35%	0.345	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.9	176.3	-67	-175.3	64.7	0	0	108.9	A75 V76 T77 C336	M53-A75 HydrophobicContact CE-CB 4.46Å; M53-V76 WeakPolarHBondContact CA-O 3.35Å; M53-V76 WeakPolarHBondContact CB-O 3.39Å; M53-T77 HydrophobicContact CG-CG2 4.14Å; M53-C336 HydrophobicContact CE-CB 3.95Å; M53-C336 HydrophobicContact SD-CB 4.18Å
54	T	98.2	Very high	97.3	Very high	9 Å²	9	27.3 Å²	27.3	6%	0.055	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	-170.5	169.7	-164	0	0	0	0	108.9	V76 I368 D369 K373	T54-V76 HydrophobicContact CG2-CG2 3.66Å; T54-V76 PolarHBondContact N-O 2.74Å; T54-V76 PolarHBondContact O-N 2.81Å; T54-V76 VanDerWaalsContact O-O 3.09Å; T54-I368 HydrophobicContact CG2-CG2 4.38Å; T54-D369 PolarHBondContact OG1-O 3.34Å; T54-K373 WeakPolarHBondContact OG1-CE 3.45Å
55	H	98.5	Very high	97.2	Very high	69 Å²	69	29.7 Å²	29.7	32%	0.319	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	158.5	168.9	64	-84.6	0	0	0	110.6	V73 E74 D369	H55-V73 HydrophobicContact CB-CG1 3.86Å; H55-E74 WeakPolarHBondContact CA-O 3.41Å; H55-D369 VanDerWaalsContact CE1-CB 3.45Å; H55-D369 WeakPolarHBondContact CE1-CB 3.32Å; H55-D369 IonicContact CE1-OD2 3.46Å; H55-D369 PolarHBondContact CE1-OD2 3.3Å; H55-D369 IonicContact ND1-OD2 3.89Å; H55-D369 PolarHBondContact ND1-OD2 2.88Å; H55-D369 IonicContact NE2-OD2 2.9Å; H55-D369 WeakPolarHBondContact O-CB 3.39Å; H55-D369 PolarHBondContact O-N 3.01Å
56	I	98.4	Very high	97.1	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	156.9	177.3	58.5	90.3	0	0	0	109.2	R58 V73 E74 V76 Y285 M332 L365 F367 I368	I56-R58 HydrophobicContact CD1-CB 3.78Å; I56-R58 HydrophobicContact CD1-CG 3.65Å; I56-V73 VanDerWaalsContact O-CA 3.3Å; I56-V73 WeakPolarHBondContact O-CA 3.11Å; I56-E74 HydrophobicContact CD1-CB 4.22Å; I56-E74 PolarHBondContact N-O 2.93Å; I56-E74 PolarHBondContact O-N 2.93Å; I56-V76 HydrophobicContact CG1-CG1 3.74Å; I56-V76 HydrophobicContact CG2-CG1 4.23Å; I56-V76 HydrophobicContact CG2-CG2 3.86Å; I56-Y285 HydrophobicContact CD1-CD2 3.95Å; I56-Y285 HydrophobicContact CD1-CE2 3.93Å; I56-Y285 HydrophobicContact CG1-CD2 4.06Å; I56-Y285 HydrophobicContact CG1-CE2 4.33Å; I56-M332 HydrophobicContact CG2-CE 3.98Å; I56-M332 HydrophobicContact CG2-SD 3.7Å; I56-L365 HydrophobicContact CB-CD2 4.25Å; I56-L365 HydrophobicContact CD1-CD2 3.66Å; I56-L365 HydrophobicContact CG1-CD2 4.04Å; I56-F367 CarbonylContact C-O 3.36Å; I56-F367 WeakPolarHBondContact CA-O 3.48Å; I56-F367 VanDerWaalsContact CB-O 3.32Å; I56-F367 WeakPolarHBondContact CB-O 3.49Å; I56-I368 HydrophobicContact CG2-CB 4.38Å; I56-I368 HydrophobicContact CG2-CG1 3.93Å; I56-I368 HydrophobicContact CG2-CG2 4.34Å
57	V	98.3	Very high	97	Very high	22 Å²	22	41.7 Å²	41.7	13%	0.133	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134	161	-173.9	0	0	0	0	107.6	E71 V72 V73 K366 F367	V57-E71 HydrophobicContact CG1-CB 3.77Å; V57-E71 HydrophobicContact CG1-CG 4.17Å; V57-V72 WeakPolarHBondContact CA-O 3.31Å; V57-V73 HydrophobicContact CG2-CG2 4.21Å; V57-K366 HydrophobicContact CG1-CB 4.42Å; V57-K366 PolarHBondContact O-N 3.45Å; V57-F367 HydrophobicContact CB-CB 3.82Å; V57-F367 HydrophobicContact CG2-CB 3.94Å; V57-F367 HydrophobicContact CG2-CD1 4.03Å; V57-F367 HydrophobicContact CG2-CG 4.42Å; V57-F367 PolarHBondContact N-O 2.99Å; V57-F367 PolarHBondContact O-N 3.29Å; V57-F367 VanDerWaalsContact O-N 3.1Å
58	R	97	Very high	96.9	Very high	1 Å²	1	43.9 Å²	43.9	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	157.5	171.2	65.2	171.9	-152.8	98	2	109.8	I56 E71 V72 E74 E361 D364 L365	I56-R58 HydrophobicContact CD1-CB 3.78Å; I56-R58 HydrophobicContact CD1-CG 3.65Å; R58-E71 WeakPolarHBondContact O-CA 2.96Å; R58-V72 HydrophobicContact CG-CG2 3.96Å; R58-V72 PolarHBondContact N-O 3.02Å; R58-V72 VanDerWaalsContact N-O 3.16Å; R58-V72 PolarHBondContact O-N 3.03Å; R58-E74 IonicContact CZ-OE2 3.77Å; R58-E74 IonicContact NE-OE2 3.21Å; R58-E74 PolarHBondContact NE-OE2 3.32Å; R58-E361 IonicContact CZ-OE1 2.8Å; R58-E361 IonicContact NH1-OE1 2.65Å; R58-E361 PolarHBondContact NH1-OE1 2.87Å; R58-E361 IonicContact NH2-OE1 3.41Å; R58-E361 PolarHBondContact NH2-OE1 2.97Å; R58-E361 IonicContact NH2-OE2 2.73Å; R58-D364 WeakPolarHBondContact CB-O 3.46Å; R58-L365 HydrophobicContact CB-CD2 4.27Å
59	E	95.7	Very high	96.7	Very high	51 Å²	51	49.5 Å²	49.5	24%	0.238	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	140.4	166.4	-166.2	170.9	129	0	0	110.6	K69 K366	E59-K69 WeakPolarHBondContact OE1-CD 3.4Å; E59-K366 WeakPolarHBondContact OE2-CE 3.28Å; E59-K366 IonicContact OE2-NZ 2.55Å; E59-K366 PolarHBondContact OE2-NZ 2.67Å
60	V	95.4	Very high	96.6	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.006	30%	0.301	C	S	.	.			trans	-93	121.3	176.1	178.4	0	0	0	0	110.2	R62 V67 K69 K70 V72	V60-R62 HydrophobicContact CG1-CB 3.82Å; V60-R62 HydrophobicContact CG1-CG 3.56Å; V60-V67 WeakPolarHBondContact CB-O 3.45Å; V60-V67 HydrophobicContact CG1-CG2 4.23Å; V60-V67 HydrophobicContact CG2-CG2 4.44Å; V60-K69 PolarHBondContact O-N 3.1Å; V60-K70 PolarHBondContact N-O 2.81Å; V60-V72 HydrophobicContact CG2-CB 3.98Å; V60-V72 HydrophobicContact CG2-CG1 3.45Å; V60-V72 VanDerWaalsContact CG2-CG1 3.45Å; V60-V72 HydrophobicContact CG2-CG2 3.27Å
61	D	94.3	Very high	96.5	Very high	78 Å²	78	60.2 Å²	60.2	42%	0.417	32%	0.324	S	S	.	.			trans	-101.9	88.2	170.7	-169.9	38.6	0	0	0	110.5	K69	D61-K69 WeakPolarHBondContact OD1-CE 3.2Å; D61-K69 IonicContact OD1-NZ 3.79Å; D61-K69 PolarHBondContact OD1-NZ 2.75Å
62	R	94.4	Very high	96.5	Very high	56 Å²	56	61.6 Å²	61.6	21%	0.211	33%	0.332	C	S	.	.			trans	-144.5	83.3	-178.7	-65.9	-176.3	-171.8	143	11.8	110.4	V60 G64 S65 N68 E361	V60-R62 HydrophobicContact CG1-CB 3.82Å; V60-R62 HydrophobicContact CG1-CG 3.56Å; R62-G64 PolarHBondContact O-N 3Å; R62-S65 WeakPolarHBondContact O-CB 3.26Å; R62-S65 PolarHBondContact O-N 2.87Å; R62-N68 PolarHBondContact N-OD1 3.29Å; R62-N68 WeakPolarHBondContact O-CB 3.29Å; R62-N68 PolarHBondContact O-OD1 3.25Å; R62-E361 IonicContact CZ-OE1 3.42Å; R62-E361 IonicContact CZ-OE2 2.77Å; R62-E361 IonicContact NE-OE1 2.69Å; R62-E361 IonicContact NE-OE2 3.94Å; R62-E361 PolarHBondContact NE-OE2 3.38Å; R62-E361 IonicContact NH2-OE1 3.64Å; R62-E361 IonicContact NH2-OE2 3.19Å; R62-E361 PolarHBondContact NH2-OE2 2.84Å
63	P	94.5	Very high	96.5	Very high	94 Å²	94	65.7 Å²	65.7	61%	0.61	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	133.1	176	-28.7	35.4	0	0	0	112.1
64	G	94.6	Very high	96.5	Very high	89 Å²	89	63.9 Å²	63.9	92%	0.918	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	-6.4	-175.3	0	0	0	0	0	115.5	R62	R62-G64 PolarHBondContact O-N 3Å
65	S	95.4	Very high	96.5	Very high	50 Å²	50	66 Å²	66	35%	0.35	36%	0.364	S	S	.	.	S	Bend	trans	-87.4	144.4	173.6	-165.7	0	0	0	0	112.3	R62 V67 N68	R62-S65 WeakPolarHBondContact O-CB 3.26Å; R62-S65 PolarHBondContact O-N 2.87Å; S65-V67 PolarHBondContact O-N 3.06Å; S65-V67 VanDerWaalsContact O-N 3.11Å; S65-V67 WeakPolarHBondContact OG-CG2 3.38Å; S65-N68 VanDerWaalsContact O-CB 3.23Å; S65-N68 WeakPolarHBondContact O-CB 3.47Å; S65-N68 PolarHBondContact O-N 3.28Å
66	K	97.3	Very high	96.5	Very high	195 Å²	195	62.8 Å²	62.8	85%	0.848	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20	171.7	-66.5	-172.3	177.5	-173.6	0	114.1	K70	K66-K70 PolarHBondContact O-NZ 2.77Å
67	V	95.6	Very high	96.5	Very high	57 Å²	57	62.8 Å²	62.8	35%	0.345	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	10	177.9	-62.1	0	0	0	0	112.7	V60 S65 K69 K70 V72	V60-V67 WeakPolarHBondContact CB-O 3.45Å; V60-V67 HydrophobicContact CG1-CG2 4.23Å; V60-V67 HydrophobicContact CG2-CG2 4.44Å; S65-V67 PolarHBondContact O-N 3.06Å; S65-V67 VanDerWaalsContact O-N 3.11Å; S65-V67 WeakPolarHBondContact OG-CG2 3.38Å; V67-K69 PolarHBondContact O-N 3.49Å; V67-K70 WeakPolarHBondContact O-CB 3.45Å; V67-K70 PolarHBondContact O-N 3.08Å; V67-K70 VanDerWaalsContact O-N 3.13Å; V67-V72 HydrophobicContact CB-CG1 4.26Å
68	N	96.2	Very high	96.6	Very high	47 Å²	47	61.7 Å²	61.7	25%	0.251	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	135	175	-170.7	46.5	0	0	0	110.5	R62 S65 K70	R62-N68 PolarHBondContact N-OD1 3.29Å; R62-N68 WeakPolarHBondContact O-CB 3.29Å; R62-N68 PolarHBondContact O-OD1 3.25Å; S65-N68 VanDerWaalsContact O-CB 3.23Å; S65-N68 WeakPolarHBondContact O-CB 3.47Å; S65-N68 PolarHBondContact O-N 3.28Å; N68-K70 PolarHBondContact O-N 2.79Å; N68-K70 VanDerWaalsContact O-N 3.13Å
69	K	95	Very high	96.6	Very high	118 Å²	118	61.7 Å²	61.7	51%	0.513	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	25.4	-176.1	-53.3	-60.3	-174.6	-171.2	0	113.7	E59 V60 D61 V67	E59-K69 WeakPolarHBondContact OE1-CD 3.4Å; V60-K69 PolarHBondContact O-N 3.1Å; D61-K69 WeakPolarHBondContact OD1-CE 3.2Å; D61-K69 IonicContact OD1-NZ 3.79Å; D61-K69 PolarHBondContact OD1-NZ 2.75Å; V67-K69 PolarHBondContact O-N 3.49Å
70	K	96.6	Very high	96.8	Very high	126 Å²	126	59.2 Å²	59.2	55%	0.548	33%	0.331	S	S	.	.	S	Bend	trans	-113.8	151.6	172.4	-62.7	-173.3	-176.7	169.5	0	110.2	V60 K66 V67 N68	V60-K70 PolarHBondContact N-O 2.81Å; K66-K70 PolarHBondContact O-NZ 2.77Å; V67-K70 WeakPolarHBondContact O-CB 3.45Å; V67-K70 PolarHBondContact O-N 3.08Å; V67-K70 VanDerWaalsContact O-N 3.13Å; N68-K70 PolarHBondContact O-N 2.79Å; N68-K70 VanDerWaalsContact O-N 3.13Å
71	E	96.8	Very high	96.9	Very high	119 Å²	119	59.2 Å²	59.2	56%	0.556	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	134.6	175	-64.5	-173.8	178.4	0	0	110.7	V57 R58 K366	V57-E71 HydrophobicContact CG1-CB 3.77Å; V57-E71 HydrophobicContact CG1-CG 4.17Å; R58-E71 WeakPolarHBondContact O-CA 2.96Å; E71-K366 HydrophobicContact CG-CD 4.02Å; E71-K366 WeakPolarHBondContact OE1-CD 3.03Å; E71-K366 IonicContact OE1-NZ 3.3Å; E71-K366 PolarHBondContact OE1-NZ 3.15Å
72	V	97.7	Very high	97.1	Very high	29 Å²	29	55.5 Å²	55.5	18%	0.176	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	142.3	174.3	-60.9	0	0	0	0	109.9	V57 R58 V60 V67 E74	V57-V72 WeakPolarHBondContact CA-O 3.31Å; R58-V72 HydrophobicContact CG-CG2 3.96Å; R58-V72 PolarHBondContact N-O 3.02Å; R58-V72 VanDerWaalsContact N-O 3.16Å; R58-V72 PolarHBondContact O-N 3.03Å; V60-V72 HydrophobicContact CG2-CB 3.98Å; V60-V72 HydrophobicContact CG2-CG1 3.45Å; V60-V72 VanDerWaalsContact CG2-CG1 3.45Å; V60-V72 HydrophobicContact CG2-CG2 3.27Å; V67-V72 HydrophobicContact CB-CG1 4.26Å; V72-E74 HydrophobicContact CG2-CG 3.98Å
73	V	98.2	Very high	97.3	Very high	98 Å²	98	53.8 Å²	53.8	59%	0.594	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.9	168.9	-179.8	0	0	0	0	108.7	H55 I56 V57	H55-V73 HydrophobicContact CB-CG1 3.86Å; I56-V73 VanDerWaalsContact O-CA 3.3Å; I56-V73 WeakPolarHBondContact O-CA 3.11Å; V57-V73 HydrophobicContact CG2-CG2 4.21Å
74	E	98.2	Very high	97.4	Very high	33 Å²	33	49.4 Å²	49.4	15%	0.154	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.9	175.7	-72.6	-176.6	142.7	0	0	111	H55 I56 R58 V72 Y285 K334	H55-E74 WeakPolarHBondContact CA-O 3.41Å; I56-E74 HydrophobicContact CD1-CB 4.22Å; I56-E74 PolarHBondContact N-O 2.93Å; I56-E74 PolarHBondContact O-N 2.93Å; R58-E74 IonicContact CZ-OE2 3.77Å; R58-E74 IonicContact NE-OE2 3.21Å; R58-E74 PolarHBondContact NE-OE2 3.32Å; V72-E74 HydrophobicContact CG2-CG 3.98Å; E74-Y285 HydrophobicContact CB-CE2 4.36Å; E74-Y285 VanDerWaalsContact OE2-CE2 3.27Å; E74-Y285 WeakPolarHBondContact OE2-CE2 3.47Å; E74-Y285 VanDerWaalsContact OE2-CZ 3.24Å; E74-Y285 PolarHBondContact OE2-OH 3.08Å; E74-K334 VanDerWaalsContact CD-NZ 3.3Å; E74-K334 IonicContact OE1-NZ 3.63Å; E74-K334 PolarHBondContact OE1-NZ 2.97Å; E74-K334 IonicContact OE2-NZ 2.81Å; E74-K334 PolarHBondContact OE2-NZ 2.85Å
75	A	98.6	Very high	97.6	Very high	54 Å²	54	46 Å²	46	45%	0.446	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	140.2	173.2	0	0	0	0	0	110.2	M53 G335	M53-A75 HydrophobicContact CE-CB 4.46Å; A75-G335 WeakPolarHBondContact O-CA 3.34Å; A75-G335 PolarHBondContact O-N 2.89Å
76	V	98.7	Very high	97.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	149.9	177.9	-64.2	0	0	0	0	111.2	M53 T54 I56 I78 Y285 M332 L333	M53-V76 WeakPolarHBondContact CA-O 3.35Å; M53-V76 WeakPolarHBondContact CB-O 3.39Å; T54-V76 HydrophobicContact CG2-CG2 3.66Å; T54-V76 PolarHBondContact N-O 2.74Å; T54-V76 PolarHBondContact O-N 2.81Å; T54-V76 VanDerWaalsContact O-O 3.09Å; I56-V76 HydrophobicContact CG1-CG1 3.74Å; I56-V76 HydrophobicContact CG2-CG1 4.23Å; I56-V76 HydrophobicContact CG2-CG2 3.86Å; V76-I78 HydrophobicContact CG2-CD1 4.3Å; V76-Y285 HydrophobicContact CG1-CD2 3.71Å; V76-Y285 HydrophobicContact CG1-CE2 4.22Å; V76-M332 HydrophobicContact CB-CG 3.64Å; V76-M332 HydrophobicContact CB-SD 4.18Å; V76-M332 HydrophobicContact CG1-CG 3.9Å; V76-M332 HydrophobicContact CG1-SD 4.02Å; V76-M332 HydrophobicContact CG2-CE 4.37Å; V76-M332 HydrophobicContact CG2-CG 3.78Å; V76-M332 HydrophobicContact CG2-SD 3.93Å; V76-L333 CarbonylContact C-O 3.56Å; V76-L333 VanDerWaalsContact CA-O 3.25Å; V76-L333 WeakPolarHBondContact CA-O 3.28Å
77	T	98.8	Very high	97.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	132.9	168.7	-57.6	0	0	0	0	109.7	K50 G52 M53 V79 L333 G335 V337	K50-T77 HydrophobicContact CD-CG2 4.18Å; K50-T77 HydrophobicContact CG-CG2 3.82Å; G52-T77 VanDerWaalsContact O-CG2 3.31Å; G52-T77 WeakPolarHBondContact O-CG2 3.48Å; M53-T77 HydrophobicContact CG-CG2 4.14Å; T77-V79 HydrophobicContact CG2-CG2 4.1Å; T77-L333 PolarHBondContact N-O 3.48Å; T77-L333 PolarHBondContact O-N 3.09Å; T77-G335 PolarHBondContact N-O 3.05Å; T77-G335 PolarHBondContact OG1-O 3.4Å; T77-V337 HydrophobicContact CG2-CG2 3.69Å; T77-V337 PolarHBondContact OG1-N 2.79Å
78	I	98.6	Very high	97.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.9	171.6	-51.7	-51.4	0	0	0	109.2	A51 G52 V76 I314 F320 V326 F330 M332	A51-I78 HydrophobicContact CB-CB 4.49Å; A51-I78 HydrophobicContact CB-CG2 4.39Å; A51-I78 PolarHBondContact N-O 2.98Å; G52-I78 PolarHBondContact O-N 3.27Å; V76-I78 HydrophobicContact CG2-CD1 4.3Å; I78-I314 HydrophobicContact CD1-CD1 3.83Å; I78-I314 HydrophobicContact CD1-CG1 3.94Å; I78-I314 HydrophobicContact CG1-CD1 4.28Å; I78-I314 HydrophobicContact CG1-CG1 4.01Å; I78-I314 HydrophobicContact CG2-CG1 4.13Å; I78-F320 HydrophobicContact CB-CE2 4.4Å; I78-F320 HydrophobicContact CB-CZ 4.02Å; I78-F320 HydrophobicContact CG1-CE1 4.37Å; I78-F320 HydrophobicContact CG1-CE2 4.41Å; I78-F320 HydrophobicContact CG1-CZ 3.68Å; I78-F320 HydrophobicContact CG2-CE2 4.4Å; I78-F320 HydrophobicContact CG2-CZ 4.46Å; I78-V326 HydrophobicContact CG2-CG2 4.22Å; I78-F330 HydrophobicContact CG2-CB 4.09Å; I78-F330 HydrophobicContact CG2-CD2 3.93Å; I78-F330 HydrophobicContact CG2-CG 4.13Å; I78-M332 HydrophobicContact CD1-CB 3.97Å; I78-M332 HydrophobicContact CD1-CE 3.88Å; I78-M332 HydrophobicContact CD1-CG 3.78Å
79	V	98.7	Very high	98	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	108.5	177.4	-177.7	0	0	0	0	108	Y49 T77 T81 F330 V331 L333 L345	Y49-V79 CarbonylContact O-C 3.58Å; Y49-V79 WeakPolarHBondContact O-CA 3.22Å; T77-V79 HydrophobicContact CG2-CG2 4.1Å; V79-T81 HydrophobicContact CG1-CG2 4.32Å; V79-F330 CarbonylContact O-C 3.47Å; V79-F330 VanDerWaalsContact O-CA 3.27Å; V79-F330 WeakPolarHBondContact O-CA 3.43Å; V79-F330 WeakPolarHBondContact O-CB 3.05Å; V79-V331 PolarHBondContact N-O 2.68Å; V79-V331 PolarHBondContact O-N 3.06Å; V79-L333 HydrophobicContact CG2-CD1 3.99Å; V79-L345 HydrophobicContact CG2-CD1 4.11Å
80	E	98.6	Very high	98.1	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.3	176.4	-173.4	171.7	-159.1	0	0	110	G48 Y49 L171 Y323 V326 T327 N328	G48-E80 CarbonylContact C-O 3.48Å; G48-E80 VanDerWaalsContact CA-O 3.23Å; G48-E80 WeakPolarHBondContact CA-O 3.21Å; Y49-E80 PolarHBondContact N-O 2.85Å; Y49-E80 PolarHBondContact O-N 3.39Å; E80-L171 HydrophobicContact CB-CD2 4.42Å; E80-L171 HydrophobicContact CG-CD2 3.88Å; E80-L171 VanDerWaalsContact OE2-CD2 3.3Å; E80-L171 WeakPolarHBondContact OE2-CD2 3.36Å; E80-Y323 WeakPolarHBondContact OE2-CE1 3.37Å; E80-Y323 VanDerWaalsContact OE2-CZ 3.25Å; E80-Y323 PolarHBondContact OE2-OH 2.8Å; E80-V326 HydrophobicContact CB-CG1 4.08Å; E80-V326 HydrophobicContact CB-CG2 4.44Å; E80-V326 HydrophobicContact CG-CG1 3.94Å; E80-T327 PolarHBondContact OE1-N 3.2Å; E80-N328 HydrophobicContact CG-CB 3.96Å; E80-N328 PolarHBondContact OE1-N 3.48Å; E80-N328 PolarHBondContact OE1-ND2 2.95Å
81	T	98.5	Very high	98.2	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.105	C	C	.	.			trans	-131.1	73.3	-169.7	44.3	0	0	0	0	109.7	F46 V79 V207 D329 F330 V331 L347	F46-T81 HydrophobicContact CD1-CG2 4.01Å; F46-T81 HydrophobicContact CE1-CG2 4.11Å; V79-T81 HydrophobicContact CG1-CG2 4.32Å; T81-V207 HydrophobicContact CG2-CB 4.46Å; T81-V207 HydrophobicContact CG2-CG2 4.16Å; T81-V207 WeakPolarHBondContact OG1-CG1 3.4Å; T81-D329 CarbonylContact C-O 3.6Å; T81-D329 WeakPolarHBondContact CA-O 3.41Å; T81-D329 PolarHBondContact N-O 2.64Å; T81-D329 PolarHBondContact OG1-O 2.74Å; T81-F330 WeakPolarHBondContact OG1-CA 3.3Å; T81-V331 HydrophobicContact CG2-CG2 4.05Å; T81-L347 HydrophobicContact CG2-CD1 4.23Å
82	P	97.8	Very high	98.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.083	C	C	.	.	P	Polyproline II helix	trans	-56.4	146.2	170.6	-15.3	27.7	0	0	0	109.9	M84 L170 L171 N328	P82-M84 PolarHBondContact O-N 2.92Å; P82-L170 HydrophobicContact CB-CB 4.25Å; P82-L170 HydrophobicContact CB-CD1 4.13Å; P82-L171 HydrophobicContact CG-CD1 4.08Å; P82-L171 HydrophobicContact CG-CD2 3.39Å; P82-L171 HydrophobicContact CG-CG 3.64Å; P82-N328 HydrophobicContact CB-CB 4.28Å; P82-N328 HydrophobicContact CG-CB 4.22Å
83	P	98	Very high	98.3	Very high	20 Å²	20	13.1 Å²	13.1	13%	0.13	8%	0.081	C	C	.	.	P	Polyproline II helix	trans	-54.8	136.7	-179.5	17.7	-29	0	0	0	111.3	Q167 L170 Q204 V205	P83-Q167 PolarHBondContact O-NE2 2.99Å; P83-L170 HydrophobicContact CG-CD1 4.45Å; P83-Q204 HydrophobicContact CB-CB 4.07Å; P83-Q204 HydrophobicContact CB-CG 4.44Å; P83-V205 WeakPolarHBondContact CA-O 3.41Å
84	M	98.5	Very high	98.2	Very high	2 Å²	2	14.8 Å²	14.8	1%	0.01	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	139.4	177.5	-72.2	-176.3	64.9	0	0	110.1	F46 L47 P82 A164 H165 T166 M181 I183 Q204 V205	F46-M84 HydrophobicContact CD1-CG 4.46Å; F46-M84 HydrophobicContact CD1-SD 4.08Å; F46-M84 HydrophobicContact CD2-CG 4.29Å; F46-M84 HydrophobicContact CD2-SD 3.82Å; F46-M84 HydrophobicContact CE1-CG 3.94Å; F46-M84 HydrophobicContact CE1-SD 4.17Å; F46-M84 HydrophobicContact CE2-CB 4.01Å; F46-M84 HydrophobicContact CE2-CG 3.8Å; F46-M84 HydrophobicContact CE2-SD 3.97Å; F46-M84 HydrophobicContact CG-SD 3.89Å; F46-M84 HydrophobicContact CZ-CB 4.1Å; F46-M84 HydrophobicContact CZ-CG 3.61Å; F46-M84 HydrophobicContact CZ-SD 4.14Å; L47-M84 HydrophobicContact CB-CE 4.29Å; L47-M84 HydrophobicContact CB-SD 3.81Å; L47-M84 HydrophobicContact CD1-CE 4.11Å; L47-M84 HydrophobicContact CG-CE 3.92Å; L47-M84 HydrophobicContact CG-SD 4.02Å; L47-M84 PolarHBondContact N-SD 2.91Å; P82-M84 PolarHBondContact O-N 2.92Å; M84-A164 HydrophobicContact CB-CB 4.44Å; M84-A164 HydrophobicContact CE-CB 3.59Å; M84-H165 CarbonylContact C-O 3.05Å; M84-H165 WeakPolarHBondContact CA-O 3.02Å; M84-H165 WeakPolarHBondContact CB-O 3.39Å; M84-T166 HydrophobicContact CG-CG2 4.2Å; M84-M181 HydrophobicContact CE-CG 3.87Å; M84-M181 HydrophobicContact CE-SD 4.22Å; M84-I183 HydrophobicContact CE-CD1 3.94Å; M84-I183 HydrophobicContact SD-CD1 4.4Å; M84-Q204 CarbonylContact O-C 3.5Å; M84-Q204 WeakPolarHBondContact O-CA 3.44Å; M84-V205 PolarHBondContact N-O 3.2Å; M84-V205 PolarHBondContact O-N 2.93Å
85	V	98.4	Very high	98.2	Very high	19 Å²	19	15.2 Å²	15.2	12%	0.115	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.3	175.9	-178.4	0	0	0	0	109	V87 A164 H165 Q167 Q203 Q204	V85-V87 HydrophobicContact CG1-CG1 3.98Å; V85-A164 CarbonylContact O-C 3.54Å; V85-A164 WeakPolarHBondContact O-CA 3.45Å; V85-H165 PolarHBondContact N-O 3.11Å; V85-H165 PolarHBondContact O-N 3.1Å; V85-Q167 HydrophobicContact CG2-CG 3.95Å; V85-Q203 WeakPolarHBondContact CA-O 3.33Å; V85-Q204 HydrophobicContact CG2-CG 3.89Å
86	V	98.3	Very high	98.1	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	126	172.4	176.1	0	0	0	0	108.7	V162 A164 R200 L201 E202 Q203 V205	V86-V162 HydrophobicContact CG1-CB 3.91Å; V86-V162 HydrophobicContact CG1-CG1 4.08Å; V86-V162 HydrophobicContact CG2-CG2 4.48Å; V86-A164 HydrophobicContact CG2-CB 4.27Å; V86-R200 WeakPolarHBondContact CB-O 3.17Å; V86-L201 HydrophobicContact CG1-CD2 4.26Å; V86-E202 WeakPolarHBondContact O-CA 3.43Å; V86-E202 PolarHBondContact O-N 3.26Å; V86-Q203 PolarHBondContact N-O 3.25Å; V86-V205 HydrophobicContact CG2-CG2 3.88Å
87	V	97.7	Very high	98	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	1.1	-173.9	-68.6	0	0	0	0	113.7	V85 F106 A107 I163 H165 L180	V85-V87 HydrophobicContact CG1-CG1 3.98Å; V87-F106 WeakPolarHBondContact O-CA 3.48Å; V87-F106 WeakPolarHBondContact O-CD1 3.23Å; V87-A107 WeakPolarHBondContact O-CB 3.43Å; V87-A107 PolarHBondContact O-N 3.41Å; V87-I163 HydrophobicContact CG2-CB 4.43Å; V87-I163 HydrophobicContact CG2-CG2 3.88Å; V87-I163 WeakPolarHBondContact CG2-O 3.48Å; V87-I163 PolarHBondContact N-O 3.44Å; V87-H165 WeakPolarHBondContact CG1-CD2 3.42Å; V87-L180 HydrophobicContact CG2-CD2 3.92Å
88	G	97.8	Very high	97.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	175	176.6	0	0	0	0	0	112.6	V105 V162 I163	G88-V105 CarbonylContact C-O 3.38Å; G88-V105 WeakPolarHBondContact CA-O 3.23Å; G88-V162 CarbonylContact O-C 3.5Å; G88-V162 WeakPolarHBondContact O-CA 3.49Å; G88-I163 PolarHBondContact N-O 2.95Å; G88-I163 PolarHBondContact O-N 3.04Å
89	I	98.3	Very high	97.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	136.8	-176.4	-50	166.6	0	0	0	107.5	T104 V105 F150 M153 I160 R161 L194 A197 R198 L201	I89-T104 CarbonylContact O-C 3.53Å; I89-T104 VanDerWaalsContact O-CA 3.3Å; I89-T104 WeakPolarHBondContact O-CA 3.46Å; I89-V105 PolarHBondContact N-O 2.85Å; I89-V105 PolarHBondContact O-N 3.14Å; I89-F150 HydrophobicContact CD1-CE1 4.02Å; I89-M153 HydrophobicContact CB-CE 4.48Å; I89-M153 HydrophobicContact CG2-CE 3.83Å; I89-I160 HydrophobicContact CG2-CG2 3.69Å; I89-R161 CarbonylContact C-O 3.52Å; I89-R161 WeakPolarHBondContact CA-O 3.43Å; I89-L194 HydrophobicContact CD1-CD1 4.33Å; I89-L194 HydrophobicContact CG2-CD1 3.79Å; I89-A197 HydrophobicContact CD1-CB 3.76Å; I89-A197 HydrophobicContact CG1-CB 3.99Å; I89-A197 HydrophobicContact CG2-CB 4.18Å; I89-R198 HydrophobicContact CD1-CB 4.31Å; I89-L201 HydrophobicContact CD1-CD1 4.19Å; I89-L201 HydrophobicContact CD1-CD2 4.16Å; I89-L201 HydrophobicContact CD1-CG 4.17Å; I89-L201 HydrophobicContact CG1-CD2 3.98Å
90	V	98.3	Very high	97.8	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124	179.6	-177	0	0	0	0	108.2	Y92 T101 K103 T104 R161 I163 E182	V90-Y92 HydrophobicContact CB-CE2 4.15Å; V90-Y92 HydrophobicContact CG1-CD2 3.93Å; V90-Y92 HydrophobicContact CG1-CE2 3.46Å; V90-Y92 VanDerWaalsContact CG1-CE2 3.46Å; V90-T101 HydrophobicContact CG1-CG2 3.42Å; V90-T101 VanDerWaalsContact CG1-CG2 3.42Å; V90-K103 WeakPolarHBondContact CA-O 3.31Å; V90-T104 HydrophobicContact CG2-CG2 3.78Å; V90-R161 PolarHBondContact N-O 3.09Å; V90-R161 PolarHBondContact O-N 3.38Å; V90-I163 HydrophobicContact CG2-CD1 3.48Å; V90-I163 VanDerWaalsContact CG2-CD1 3.48Å; V90-I163 HydrophobicContact CG2-CG1 3.59Å; V90-E182 HydrophobicContact CG2-CG 4.46Å
91	G	98.3	Very high	97.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	136	170.3	0	0	0	0	0	110.5	F102 K103 C157	G91-F102 WeakPolarHBondContact O-CB 3.11Å; G91-F102 PolarHBondContact O-N 3.15Å; G91-K103 PolarHBondContact N-O 3.44Å; G91-C157 VanDerWaalsContact CA-SG 3.53Å
92	Y	98.5	Very high	97.7	Very high	23 Å²	23	49.9 Å²	49.9	9%	0.09	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130	172.5	-75.5	-92.5	0	0	0	109.9	V90 L99 R100 T101 C157 Q158 V159 R161 E182	V90-Y92 HydrophobicContact CB-CE2 4.15Å; V90-Y92 HydrophobicContact CG1-CD2 3.93Å; V90-Y92 HydrophobicContact CG1-CE2 3.46Å; V90-Y92 VanDerWaalsContact CG1-CE2 3.46Å; Y92-L99 HydrophobicContact CD1-CB 4.12Å; Y92-R100 WeakPolarHBondContact CA-O 3.24Å; Y92-T101 HydrophobicContact CE1-CG2 4.47Å; Y92-T101 WeakPolarHBondContact CE1-OG1 3.36Å; Y92-C157 WeakPolarHBondContact O-CA 3.41Å; Y92-C157 WeakPolarHBondContact O-CB 3.46Å; Y92-Q158 PolarHBondContact O-N 3.29Å; Y92-V159 PolarHBondContact N-O 3.24Å; Y92-V159 PolarHBondContact O-N 3.3Å; Y92-R161 HydrophobicContact CD2-CG 4.06Å; Y92-R161 HydrophobicContact CE2-CB 4.43Å; Y92-R161 HydrophobicContact CE2-CG 3.93Å; Y92-E182 WeakPolarHBondContact CE2-OE2 3.49Å; Y92-E182 PolarHBondContact OH-OE1 2.73Å; Y92-E182 PolarHBondContact OH-OE2 3.19Å
93	V	98	Very high	97.7	Very high	22 Å²	22	52.6 Å²	52.6	13%	0.133	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136.6	172.3	63.1	0	0	0	0	109.5	T95 L99 R100 F102 Y156 Q158	V93-T95 HydrophobicContact CG1-CG2 4.26Å; V93-L99 WeakPolarHBondContact O-CA 3.5Å; V93-R100 HydrophobicContact CG1-CB 4.21Å; V93-R100 PolarHBondContact N-O 3.29Å; V93-R100 PolarHBondContact O-N 2.81Å; V93-F102 HydrophobicContact CB-CB 4.22Å; V93-F102 HydrophobicContact CB-CD2 4.4Å; V93-F102 HydrophobicContact CG1-CB 4.06Å; V93-F102 HydrophobicContact CG1-CD2 4.11Å; V93-F102 HydrophobicContact CG1-CG 4.48Å; V93-Y156 WeakPolarHBondContact CG2-O 3.34Å; V93-Q158 VanDerWaalsContact CA-OE1 3.28Å
94	E	96.8	Very high	97.6	Very high	133 Å²	133	54 Å²	54	62%	0.621	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	130	171.7	-172	163.6	-158.6	0	0	109.9	L99 Q158	E94-L99 HydrophobicContact CB-CD2 4.09Å; E94-Q158 HydrophobicContact CB-CG 4.2Å
95	T	97.3	Very high	97.6	Very high	42 Å²	42	53.9 Å²	53.9	26%	0.258	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	162.6	175.5	73.5	0	0	0	0	107.9	V93 R97 G98 R100	V93-T95 HydrophobicContact CG1-CG2 4.26Å; T95-R97 PolarHBondContact O-N 3.44Å; T95-R97 PolarHBondContact OG1-N 3.37Å; T95-G98 WeakPolarHBondContact CB-O 3.42Å; T95-G98 PolarHBondContact N-O 2.88Å; T95-G98 WeakPolarHBondContact O-CA 3.28Å; T95-G98 PolarHBondContact O-N 3.2Å; T95-G98 PolarHBondContact OG1-O 3.18Å; T95-R100 HydrophobicContact CG2-CB 4.01Å
96	P	97.3	Very high	97.5	Very high	145 Å²	145	54.6 Å²	54.6	94%	0.942	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.8	174	-27.1	35.8	0	0	0	114.4
97	R	96.4	Very high	97.4	Very high	247 Å²	247	54.6 Å²	54.6	93%	0.932	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	7.7	176.5	-59.7	-175.4	-178.9	177.9	0.9	113.5	T95	T95-R97 PolarHBondContact O-N 3.44Å; T95-R97 PolarHBondContact OG1-N 3.37Å
98	G	96.1	Very high	97.2	Very high	35 Å²	35	56.8 Å²	56.8	36%	0.361	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	103.4	-167.5	-175.2	0	0	0	0	0	113.3	T95 R100	T95-G98 WeakPolarHBondContact CB-O 3.42Å; T95-G98 PolarHBondContact N-O 2.88Å; T95-G98 WeakPolarHBondContact O-CA 3.28Å; T95-G98 PolarHBondContact O-N 3.2Å; T95-G98 PolarHBondContact OG1-O 3.18Å; G98-R100 PolarHBondContact O-N 3.1Å
99	L	96.9	Very high	97.1	Very high	83 Å²	83	62.4 Å²	62.4	44%	0.435	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	124.7	-179	-65.5	174.3	0	0	0	111.3	Y92 V93 E94 V159	Y92-L99 HydrophobicContact CD1-CB 4.12Å; V93-L99 WeakPolarHBondContact O-CA 3.5Å; E94-L99 HydrophobicContact CB-CD2 4.09Å; L99-V159 HydrophobicContact CD1-CG2 4.17Å; L99-V159 HydrophobicContact CD2-CG2 4.31Å
100	R	97.7	Very high	97	Very high	146 Å²	146	62.9 Å²	62.9	55%	0.551	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	139.5	173.1	-173.2	176.2	66.1	94.7	-4.7	109.9	Y92 V93 T95 G98 F102	Y92-R100 WeakPolarHBondContact CA-O 3.24Å; V93-R100 HydrophobicContact CG1-CB 4.21Å; V93-R100 PolarHBondContact N-O 3.29Å; V93-R100 PolarHBondContact O-N 2.81Å; T95-R100 HydrophobicContact CG2-CB 4.01Å; G98-R100 PolarHBondContact O-N 3.1Å; R100-F102 PolarHBondContact O-N 3.09Å
101	T	97.9	Very high	96.8	Very high	67 Å²	67	64.8 Å²	64.8	41%	0.411	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	121.9	172.2	-39.7	0	0	0	0	109.2	V90 Y92	V90-T101 HydrophobicContact CG1-CG2 3.42Å; V90-T101 VanDerWaalsContact CG1-CG2 3.42Å; Y92-T101 HydrophobicContact CE1-CG2 4.47Å; Y92-T101 WeakPolarHBondContact CE1-OG1 3.36Å
102	F	97.3	Very high	96.7	Very high	58 Å²	58	69.2 Å²	69.2	25%	0.254	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-63.3	-176.8	-177.6	-111.4	0	0	0	111.1	G91 V93 R100 M153 Y156 C157	G91-F102 WeakPolarHBondContact O-CB 3.11Å; G91-F102 PolarHBondContact O-N 3.15Å; V93-F102 HydrophobicContact CB-CB 4.22Å; V93-F102 HydrophobicContact CB-CD2 4.4Å; V93-F102 HydrophobicContact CG1-CB 4.06Å; V93-F102 HydrophobicContact CG1-CD2 4.11Å; V93-F102 HydrophobicContact CG1-CG 4.48Å; R100-F102 PolarHBondContact O-N 3.09Å; F102-M153 HydrophobicContact CD1-CG 4.34Å; F102-Y156 HydrophobicContact CE1-CD2 4.13Å; F102-Y156 HydrophobicContact CE2-CD2 4.43Å; F102-Y156 AromaticContact CZ-CD2 3.63Å; F102-Y156 HydrophobicContact CZ-CD2 3.63Å; F102-Y156 HydrophobicContact CZ-CE2 4.49Å; F102-Y156 HydrophobicContact CZ-CG 4.11Å; F102-C157 VanDerWaalsContact CD1-SG 3.57Å
103	K	97	Very high	96.6	Very high	58 Å²	58	69 Å²	69	25%	0.252	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	156.1	177.3	-75.1	-178.6	178.3	-84.9	0	110.5	V90 G91 D149 M153	V90-K103 WeakPolarHBondContact CA-O 3.31Å; G91-K103 PolarHBondContact N-O 3.44Å; K103-D149 HydrophobicContact CD-CB 3.9Å; K103-D149 WeakPolarHBondContact CE-OD1 3.2Å; K103-D149 IonicContact NZ-OD1 2.66Å; K103-D149 PolarHBondContact NZ-OD1 3.01Å; K103-M153 HydrophobicContact CB-CG 4.01Å; K103-M153 HydrophobicContact CB-SD 3.98Å
104	T	97.4	Very high	96.5	Very high	48 Å²	48	68 Å²	68	29%	0.294	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	120	174.1	-58.5	0	0	0	0	108.6	I89 V90 F106 I163	I89-T104 CarbonylContact O-C 3.53Å; I89-T104 VanDerWaalsContact O-CA 3.3Å; I89-T104 WeakPolarHBondContact O-CA 3.46Å; V90-T104 HydrophobicContact CG2-CG2 3.78Å; T104-F106 HydrophobicContact CG2-CD2 3.92Å; T104-F106 HydrophobicContact CG2-CE2 3.43Å; T104-F106 VanDerWaalsContact CG2-CE2 3.43Å; T104-F106 HydrophobicContact CG2-CZ 3.84Å; T104-I163 HydrophobicContact CG2-CD1 3.73Å
105	V	96.9	Very high	96.5	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.3	175.5	179.6	0	0	0	0	108	G88 I89 Y133 W137 L146 D149 F150 M153	G88-V105 CarbonylContact C-O 3.38Å; G88-V105 WeakPolarHBondContact CA-O 3.23Å; I89-V105 PolarHBondContact N-O 2.85Å; I89-V105 PolarHBondContact O-N 3.14Å; V105-Y133 WeakPolarHBondContact CA-OH 3.37Å; V105-W137 HydrophobicContact CG1-CH2 4.42Å; V105-W137 HydrophobicContact CG1-CZ2 3.91Å; V105-L146 HydrophobicContact CG1-CD2 3.77Å; V105-D149 HydrophobicContact CG2-CB 4.16Å; V105-F150 HydrophobicContact CB-CE1 4.5Å; V105-F150 HydrophobicContact CB-CZ 4.38Å; V105-F150 HydrophobicContact CG1-CE1 4.32Å; V105-F150 HydrophobicContact CG1-CE2 4.21Å; V105-F150 HydrophobicContact CG1-CZ 3.73Å; V105-F150 HydrophobicContact CG2-CE1 4.47Å; V105-M153 HydrophobicContact CG2-SD 4.06Å
106	F	97	Very high	96.5	Very high	35 Å²	35	63.7 Å²	63.7	15%	0.154	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	155	173.2	-73.2	-88	0	0	0	111.3	V87 T104 I110 F130 Y133 W137 I163	V87-F106 WeakPolarHBondContact O-CA 3.48Å; V87-F106 WeakPolarHBondContact O-CD1 3.23Å; T104-F106 HydrophobicContact CG2-CD2 3.92Å; T104-F106 HydrophobicContact CG2-CE2 3.43Å; T104-F106 VanDerWaalsContact CG2-CE2 3.43Å; T104-F106 HydrophobicContact CG2-CZ 3.84Å; F106-I110 HydrophobicContact CB-CD1 4.17Å; F106-I110 HydrophobicContact CD1-CD1 4.23Å; F106-F130 HydrophobicContact CB-CD1 4.35Å; F106-F130 HydrophobicContact CB-CE1 4.13Å; F106-F130 HydrophobicContact CD1-CD1 4.48Å; F106-F130 AromaticContact CD1-CE1 3.58Å; F106-F130 HydrophobicContact CD1-CE1 3.58Å; F106-F130 AromaticContact CD1-CZ 3.98Å; F106-F130 HydrophobicContact CD1-CZ 3.98Å; F106-F130 HydrophobicContact CD2-CD1 4.46Å; F106-F130 AromaticContact CD2-CE1 3.63Å; F106-F130 HydrophobicContact CD2-CE1 3.63Å; F106-F130 AromaticContact CE1-CE1 3.78Å; F106-F130 HydrophobicContact CE1-CE1 3.78Å; F106-F130 AromaticContact CE1-CZ 3.78Å; F106-F130 HydrophobicContact CE1-CZ 3.78Å; F106-F130 AromaticContact CE2-CE1 3.81Å; F106-F130 HydrophobicContact CE2-CE1 3.81Å; F106-F130 HydrophobicContact CE2-CZ 4.32Å; F106-F130 HydrophobicContact CG-CD1 4.2Å; F106-F130 AromaticContact CG-CE1 3.5Å; F106-F130 HydrophobicContact CG-CE1 3.5Å; F106-F130 HydrophobicContact CG-CZ 4.34Å; F106-F130 AromaticContact CZ-CE1 3.88Å; F106-F130 HydrophobicContact CZ-CE1 3.88Å; F106-F130 AromaticContact CZ-CZ 3.96Å; F106-F130 HydrophobicContact CZ-CZ 3.96Å; F106-Y133 HydrophobicContact CB-CD1 4.02Å; F106-Y133 HydrophobicContact CB-CE1 3.66Å; F106-Y133 PolarHBondContact N-OH 2.92Å; F106-Y133 VanDerWaalsContact N-OH 3.1Å; F106-Y133 WeakPolarHBondContact O-CE1 3.45Å; F106-W137 WeakPolarHBondContact O-CZ2 3.35Å; F106-W137 PolarHBondContact O-NE1 2.75Å; F106-I163 HydrophobicContact CE1-CD1 3.75Å; F106-I163 HydrophobicContact CZ-CD1 3.86Å
107	A	95.7	Very high	96.4	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.286	C	S	.	.			trans	-61.7	164.2	173.7	0	0	0	0	0	113.3	V87 L201 E202	V87-A107 WeakPolarHBondContact O-CB 3.43Å; V87-A107 PolarHBondContact O-N 3.41Å; A107-L201 HydrophobicContact CB-CB 4.47Å; A107-L201 HydrophobicContact CB-CD2 4.25Å; A107-E202 HydrophobicContact CB-CG 3.55Å
108	E	95.1	Very high	96.4	Very high	48 Å²	48	53.6 Å²	53.6	22%	0.224	26%	0.262	C	S	.	.	S	Bend	trans	-70.6	-49.2	175.1	-178	173.1	177.9	0	0	110.3	C134 W137 Q138 E202	E108-C134 VanDerWaalsContact O-CB 3.31Å; E108-C134 WeakPolarHBondContact O-CB 3.17Å; E108-C134 PolarHBondContact O-SG 2.91Å; E108-W137 VanDerWaalsContact CA-CD1 3.48Å; E108-W137 HydrophobicContact CB-CB 3.85Å; E108-W137 HydrophobicContact CB-CD2 4.23Å; E108-W137 HydrophobicContact CB-CG 3.67Å; E108-W137 HydrophobicContact CG-CB 3.75Å; E108-W137 HydrophobicContact CG-CG 4.1Å; E108-Q138 WeakPolarHBondContact OE1-CG 3.46Å; E108-Q138 PolarHBondContact OE1-NE2 3.4Å; E108-E202 WeakPolarHBondContact CA-OE1 3.41Å; E108-E202 WeakPolarHBondContact CB-OE1 3.39Å; E108-E202 PolarHBondContact N-OE1 3.47Å
109	H	95.4	Very high	96.5	Very high	118 Å²	118	54.2 Å²	54.2	55%	0.546	25%	0.254	S	S	.	.			trans	-103.7	114.4	-178.9	-56.3	-51.7	0	0	0	111.3	E202	H109-E202 WeakPolarHBondContact CB-OE2 3.36Å; H109-E202 IonicContact CD2-OE2 3.25Å; H109-E202 PolarHBondContact CD2-OE2 2.86Å; H109-E202 VanDerWaalsContact CD2-OE2 3.25Å; H109-E202 IonicContact CG-OE2 3.72Å; H109-E202 PolarHBondContact N-OE1 3.15Å
110	I	95.4	Very high	96.4	Very high	9 Å²	9	60.8 Å²	60.8	5%	0.046	28%	0.279	C	S	.	.			trans	-115.3	122.8	176	-57.4	173.7	0	0	0	109.4	F106 C114 K115 F130	F106-I110 HydrophobicContact CB-CD1 4.17Å; F106-I110 HydrophobicContact CD1-CD1 4.23Å; I110-C114 HydrophobicContact CG2-CB 3.74Å; I110-K115 HydrophobicContact CB-CG 4.45Å; I110-K115 HydrophobicContact CG2-CG 3.95Å; I110-K115 WeakPolarHBondContact O-CE 3.49Å; I110-K115 PolarHBondContact O-NZ 3.12Å; I110-F130 HydrophobicContact CD1-CB 3.95Å; I110-F130 HydrophobicContact CD1-CD1 3.42Å; I110-F130 VanDerWaalsContact CD1-CD1 3.42Å; I110-F130 HydrophobicContact CD1-CD2 3.83Å; I110-F130 HydrophobicContact CD1-CE1 3.8Å; I110-F130 HydrophobicContact CD1-CE2 4.18Å; I110-F130 HydrophobicContact CD1-CG 3.44Å; I110-F130 VanDerWaalsContact CD1-CG 3.44Å; I110-F130 HydrophobicContact CD1-CZ 4.16Å
111	S	95.2	Very high	96.3	Very high	43 Å²	43	57.6 Å²	57.6	30%	0.301	27%	0.273	S	S	.	.			trans	-57.5	149.3	178.7	70.2	0	0	0	0	113	E113 C114 K115 H165	S111-E113 VanDerWaalsContact C-N 3.29Å; S111-E113 PolarHBondContact O-N 2.94Å; S111-E113 WeakPolarHBondContact OG-CG 3.27Å; S111-C114 WeakPolarHBondContact O-CB 3.27Å; S111-C114 PolarHBondContact O-N 3.21Å; S111-C114 VanDerWaalsContact O-N 3.11Å; S111-C114 VanDerWaalsContact OG-CB 3.27Å; S111-C114 WeakPolarHBondContact OG-CB 3.41Å; S111-C114 PolarHBondContact OG-N 3.39Å; S111-K115 PolarHBondContact O-N 3.11Å; S111-H165 PolarHBondContact OG-CE1 2.93Å; S111-H165 PolarHBondContact OG-NE2 3.42Å
112	D	95.3	Very high	96.2	Very high	93 Å²	93	55.2 Å²	55.2	50%	0.497	26%	0.256	S	S	.	.	H	α-helix	trans	-62.4	-35.3	178.3	-87.4	3.2	0	0	0	113	C114 K115 R116 W122	D112-C114 VanDerWaalsContact C-N 3.27Å; D112-C114 PolarHBondContact O-N 3.3Å; D112-K115 PolarHBondContact O-N 2.99Å; D112-R116 VanDerWaalsContact O-CG 3.28Å; D112-R116 WeakPolarHBondContact O-CG 3.44Å; D112-R116 PolarHBondContact O-N 3.14Å; D112-W122 HydrophobicContact CB-CH2 4.16Å; D112-W122 HydrophobicContact CB-CZ2 3.98Å
113	E	95.9	Very high	96.1	Very high	19 Å²	19	58.8 Å²	58.8	9%	0.089	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-31.7	175.8	60.1	175.2	-179.7	0	0	112.8	S111 R116 H165 Q167 M168 R169 K176 A178	S111-E113 VanDerWaalsContact C-N 3.29Å; S111-E113 PolarHBondContact O-N 2.94Å; S111-E113 WeakPolarHBondContact OG-CG 3.27Å; E113-R116 WeakPolarHBondContact O-CB 3.21Å; E113-H165 IonicContact OE1-CE1 3.52Å; E113-H165 IonicContact OE1-ND1 3.85Å; E113-Q167 VanDerWaalsContact OE1-CA 3.27Å; E113-Q167 WeakPolarHBondContact OE1-CA 3.4Å; E113-Q167 WeakPolarHBondContact OE1-CG 3.33Å; E113-M168 PolarHBondContact OE2-N 3.35Å; E113-R169 PolarHBondContact OE2-N 3.21Å; E113-K176 WeakPolarHBondContact CB-O 3.09Å; E113-A178 HydrophobicContact CB-CB 4.11Å; E113-A178 HydrophobicContact CG-CB 4.06Å; E113-A178 VanDerWaalsContact O-CB 3.24Å; E113-A178 WeakPolarHBondContact O-CB 3.41Å; E113-A178 PolarHBondContact O-N 2.92Å
114	C	96.6	Very high	96	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-72.5	-48.6	171.2	-177	0	0	0	0	111.1	I110 S111 D112 R116 R117	I110-C114 HydrophobicContact CG2-CB 3.74Å; S111-C114 WeakPolarHBondContact O-CB 3.27Å; S111-C114 PolarHBondContact O-N 3.21Å; S111-C114 VanDerWaalsContact O-N 3.11Å; S111-C114 VanDerWaalsContact OG-CB 3.27Å; S111-C114 WeakPolarHBondContact OG-CB 3.41Å; S111-C114 PolarHBondContact OG-N 3.39Å; D112-C114 VanDerWaalsContact C-N 3.27Å; D112-C114 PolarHBondContact O-N 3.3Å; C114-R116 PolarHBondContact O-N 2.96Å; C114-R117 WeakPolarHBondContact O-CA 3.39Å; C114-R117 WeakPolarHBondContact O-CB 3.38Å; C114-R117 PolarHBondContact O-N 3.5Å
115	K	96.9	Very high	96	Very high	38 Å²	38	63.9 Å²	63.9	17%	0.165	30%	0.295	C	S	.	.	H	α-helix	trans	-57	-34.2	176	-70.7	173.4	177.3	152.8	0	112.3	I110 S111 D112 R117 F118 Y119 W122 F130	I110-K115 HydrophobicContact CB-CG 4.45Å; I110-K115 HydrophobicContact CG2-CG 3.95Å; I110-K115 WeakPolarHBondContact O-CE 3.49Å; I110-K115 PolarHBondContact O-NZ 3.12Å; S111-K115 PolarHBondContact O-N 3.11Å; D112-K115 PolarHBondContact O-N 2.99Å; K115-R117 PolarHBondContact O-N 3.12Å; K115-F118 PolarHBondContact O-N 3.04Å; K115-Y119 WeakPolarHBondContact O-CD2 3.34Å; K115-W122 HydrophobicContact CB-CH2 3.83Å; K115-W122 HydrophobicContact CB-CZ3 3.64Å; K115-F130 HydrophobicContact CG-CD2 4.39Å
116	R	97.3	Very high	95.9	Very high	45 Å²	45	72.9 Å²	72.9	17%	0.17	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-53.9	-25.3	171.2	-78.5	173.9	-174.7	-94.2	3.6	112.9	D112 E113 C114 F118 Y119 W122 H123 K176 K177	D112-R116 VanDerWaalsContact O-CG 3.28Å; D112-R116 WeakPolarHBondContact O-CG 3.44Å; D112-R116 PolarHBondContact O-N 3.14Å; E113-R116 WeakPolarHBondContact O-CB 3.21Å; C114-R116 PolarHBondContact O-N 2.96Å; R116-F118 PolarHBondContact O-N 3.23Å; R116-Y119 PolarHBondContact O-N 2.92Å; R116-Y119 VanDerWaalsContact O-O 3.05Å; R116-W122 HydrophobicContact CB-CD2 4.49Å; R116-W122 HydrophobicContact CB-CE3 4.14Å; R116-W122 HydrophobicContact CG-CB 4.09Å; R116-W122 HydrophobicContact CG-CD2 3.37Å; R116-W122 HydrophobicContact CG-CE3 3.44Å; R116-W122 VanDerWaalsContact CG-CE3 3.44Å; R116-W122 HydrophobicContact CG-CG 3.68Å; R116-W122 HydrophobicContact CG-CH2 4.45Å; R116-W122 HydrophobicContact CG-CZ2 4.41Å; R116-W122 HydrophobicContact CG-CZ3 4.01Å; R116-W122 VanDerWaalsContact NH2-CD1 3.29Å; R116-H123 PolarHBondContact NH1-NE2 2.8Å; R116-K176 WeakPolarHBondContact CD-O 3.46Å; R116-K177 HydrophobicContact CB-CB 4.34Å; R116-K177 HydrophobicContact CB-CG 4.14Å; R116-K177 WeakPolarHBondContact O-CE 3.3Å; R116-K177 PolarHBondContact O-NZ 3.18Å
117	R	95.5	Very high	95.9	Very high	80 Å²	80	76.1 Å²	76.1	30%	0.302	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-57.4	-36.2	175.8	-166	51.1	61.1	-176	5.4	112.5	C114 K115 K177 A178 H179 L180	C114-R117 WeakPolarHBondContact O-CA 3.39Å; C114-R117 WeakPolarHBondContact O-CB 3.38Å; C114-R117 PolarHBondContact O-N 3.5Å; K115-R117 PolarHBondContact O-N 3.12Å; R117-K177 PolarHBondContact NH2-O 2.81Å; R117-K177 WeakPolarHBondContact O-CE 3.46Å; R117-K177 PolarHBondContact O-NZ 3.34Å; R117-K177 VanDerWaalsContact O-NZ 3.16Å; R117-A178 PolarHBondContact NE-O 3.44Å; R117-A178 PolarHBondContact NH2-O 3.19Å; R117-H179 PolarHBondContact NH2-CD2 3.1Å; R117-L180 HydrophobicContact CB-CD1 3.71Å; R117-L180 HydrophobicContact CB-CG 4.41Å; R117-L180 HydrophobicContact CG-CB 4.32Å; R117-L180 HydrophobicContact CG-CD1 3.75Å; R117-L180 HydrophobicContact CG-CG 4.32Å
118	F	96.2	Very high	95.9	Very high	100 Å²	100	82.9 Å²	82.9	44%	0.439	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-86.5	-4.1	-175.2	-56.9	-89.5	0	0	0	113.9	K115 R116 A129 F130 L180	K115-F118 PolarHBondContact O-N 3.04Å; R116-F118 PolarHBondContact O-N 3.23Å; F118-A129 HydrophobicContact CB-CB 4.36Å; F118-F130 HydrophobicContact CD1-CE2 4.3Å; F118-F130 AromaticContact CD2-CE2 3.65Å; F118-F130 HydrophobicContact CD2-CE2 3.65Å; F118-F130 HydrophobicContact CD2-CZ 4.42Å; F118-F130 HydrophobicContact CE1-CE2 4.03Å; F118-F130 AromaticContact CE1-CZ 3.9Å; F118-F130 HydrophobicContact CE1-CZ 3.9Å; F118-F130 AromaticContact CE2-CE2 3.37Å; F118-F130 HydrophobicContact CE2-CE2 3.37Å; F118-F130 AromaticContact CE2-CZ 3.8Å; F118-F130 HydrophobicContact CE2-CZ 3.8Å; F118-F130 HydrophobicContact CG-CE2 4.12Å; F118-F130 AromaticContact CZ-CE2 3.57Å; F118-F130 HydrophobicContact CZ-CE2 3.57Å; F118-F130 AromaticContact CZ-CZ 3.49Å; F118-F130 HydrophobicContact CZ-CZ 3.49Å; F118-F130 VanDerWaalsContact CZ-CZ 3.49Å; F118-L180 HydrophobicContact CE2-CD1 3.7Å; F118-L180 HydrophobicContact CZ-CD1 3.82Å
119	Y	96.9	Very high	95.9	Very high	48 Å²	48	81.3 Å²	81.3	19%	0.188	37%	0.373	C	S	.	.			trans	-113.4	137.3	174.3	-66.2	-76.4	0	0	0	111.3	K115 R116 W122 S125 K127 K128 A129 K177	K115-Y119 WeakPolarHBondContact O-CD2 3.34Å; R116-Y119 PolarHBondContact O-N 2.92Å; R116-Y119 VanDerWaalsContact O-O 3.05Å; Y119-W122 AromaticContact CD2-CE3 3.47Å; Y119-W122 HydrophobicContact CD2-CE3 3.47Å; Y119-W122 VanDerWaalsContact CD2-CE3 3.47Å; Y119-W122 AromaticContact CD2-CZ3 3.63Å; Y119-W122 HydrophobicContact CD2-CZ3 3.63Å; Y119-W122 HydrophobicContact CE2-CE3 4.06Å; Y119-W122 AromaticContact CE2-CZ3 3.82Å; Y119-W122 HydrophobicContact CE2-CZ3 3.82Å; Y119-W122 HydrophobicContact CG-CE3 4.19Å; Y119-S125 VanDerWaalsContact CD1-CB 3.46Å; Y119-S125 WeakPolarHBondContact CD1-OG 3.46Å; Y119-S125 WeakPolarHBondContact CE1-OG 3.48Å; Y119-K127 VanDerWaalsContact OH-C 3.27Å; Y119-K127 WeakPolarHBondContact OH-CA 3.44Å; Y119-K128 PolarHBondContact OH-N 2.92Å; Y119-A129 HydrophobicContact CE2-CB 3.55Å; Y119-A129 PolarHBondContact OH-N 2.77Å; Y119-K177 PolarHBondContact O-NZ 3.32Å
120	K	95.2	Very high	95.9	Very high	222 Å²	222	77.3 Å²	77.3	97%	0.965	35%	0.354	S	S	*	.	S	Bend	trans	-75	-45.2	163.9	-70.6	-177.5	-179.1	175.3	0	110
121	N	96	Very high	95.7	Very high	78 Å²	78	79.7 Å²	79.7	42%	0.417	37%	0.369	S	S	.	.	S	Bend	trans	-119.9	106.6	174.1	-169.7	-18.1	0	0	0	109.9	H123 K124 S125	N121-H123 PolarHBondContact OD1-N 3.44Å; N121-K124 WeakPolarHBondContact ND2-CD 3.48Å; N121-K124 WeakPolarHBondContact ND2-CG 3.2Å; N121-K124 PolarHBondContact OD1-N 3.04Å; N121-S125 WeakPolarHBondContact O-CB 3.22Å
122	W	96	Very high	95.6	Very high	17 Å²	17	86.3 Å²	86.3	6%	0.064	39%	0.393	C	S	.	.	S	Bend	trans	-75.1	-38.5	-178.7	173.7	-94.1	0	0	0	113.2	D112 K115 R116 Y119 S125 K127	D112-W122 HydrophobicContact CB-CH2 4.16Å; D112-W122 HydrophobicContact CB-CZ2 3.98Å; K115-W122 HydrophobicContact CB-CH2 3.83Å; K115-W122 HydrophobicContact CB-CZ3 3.64Å; R116-W122 HydrophobicContact CB-CD2 4.49Å; R116-W122 HydrophobicContact CB-CE3 4.14Å; R116-W122 HydrophobicContact CG-CB 4.09Å; R116-W122 HydrophobicContact CG-CD2 3.37Å; R116-W122 HydrophobicContact CG-CE3 3.44Å; R116-W122 VanDerWaalsContact CG-CE3 3.44Å; R116-W122 HydrophobicContact CG-CG 3.68Å; R116-W122 HydrophobicContact CG-CH2 4.45Å; R116-W122 HydrophobicContact CG-CZ2 4.41Å; R116-W122 HydrophobicContact CG-CZ3 4.01Å; R116-W122 VanDerWaalsContact NH2-CD1 3.29Å; Y119-W122 AromaticContact CD2-CE3 3.47Å; Y119-W122 HydrophobicContact CD2-CE3 3.47Å; Y119-W122 VanDerWaalsContact CD2-CE3 3.47Å; Y119-W122 AromaticContact CD2-CZ3 3.63Å; Y119-W122 HydrophobicContact CD2-CZ3 3.63Å; Y119-W122 HydrophobicContact CE2-CE3 4.06Å; Y119-W122 AromaticContact CE2-CZ3 3.82Å; Y119-W122 HydrophobicContact CE2-CZ3 3.82Å; Y119-W122 HydrophobicContact CG-CE3 4.19Å; W122-S125 PolarHBondContact O-N 3.13Å; W122-S125 PolarHBondContact O-OG 3.2Å; W122-K127 HydrophobicContact CD2-CG 4.4Å; W122-K127 HydrophobicContact CH2-CB 4.36Å; W122-K127 HydrophobicContact CH2-CD 4.48Å; W122-K127 HydrophobicContact CH2-CG 4.23Å; W122-K127 HydrophobicContact CZ2-CD 3.92Å; W122-K127 HydrophobicContact CZ2-CG 4.08Å; W122-K127 HydrophobicContact CZ3-CG 4.43Å
123	H	94.8	Very high	95.6	Very high	134 Å²	134	84 Å²	84	62%	0.62	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-29.7	-170.8	-71.5	-87.9	0	0	0	112.3	R116 N121	R116-H123 PolarHBondContact NH1-NE2 2.8Å; N121-H123 PolarHBondContact OD1-N 3.44Å
124	K	96.2	Very high	95.4	Very high	184 Å²	184	84.1 Å²	84.1	80%	0.8	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-1.5	175	-61.3	-166.4	-179.4	-171.2	0	114.1	N121	N121-K124 WeakPolarHBondContact ND2-CD 3.48Å; N121-K124 WeakPolarHBondContact ND2-CG 3.2Å; N121-K124 PolarHBondContact OD1-N 3.04Å
125	S	95.7	Very high	95.2	Very high	29 Å²	29	90.9 Å²	90.9	20%	0.203	41%	0.409	C	S	.	.	S	Bend	trans	-92.4	157.6	-178.1	78.5	0	0	0	0	111.9	Y119 N121 W122 K127	Y119-S125 VanDerWaalsContact CD1-CB 3.46Å; Y119-S125 WeakPolarHBondContact CD1-OG 3.46Å; Y119-S125 WeakPolarHBondContact CE1-OG 3.48Å; N121-S125 WeakPolarHBondContact O-CB 3.22Å; W122-S125 PolarHBondContact O-N 3.13Å; W122-S125 PolarHBondContact O-OG 3.2Å; S125-K127 PolarHBondContact O-N 3.35Å; S125-K127 PolarHBondContact OG-N 2.88Å
126	K	96.5	Very high	95	Very high	188 Å²	188	93 Å²	93	82%	0.817	42%	0.418	S	S	*	.			trans	-72.5	0.8	172.4	-59.6	-175.3	179.9	-176.7	0	113.7	K128	K126-K128 HydrophobicContact CB-CG 4.05Å; K126-K128 PolarHBondContact O-N 3.07Å; K126-K128 VanDerWaalsContact O-N 3.1Å
127	K	95.8	Very high	94.9	Very high	103 Å²	103	92.9 Å²	92.9	45%	0.448	42%	0.418	S	S	.	.			trans	51.9	30.3	178.3	-53.8	168	-167.5	165.5	0	115.7	Y119 W122 S125 A129	Y119-K127 VanDerWaalsContact OH-C 3.27Å; Y119-K127 WeakPolarHBondContact OH-CA 3.44Å; W122-K127 HydrophobicContact CD2-CG 4.4Å; W122-K127 HydrophobicContact CH2-CB 4.36Å; W122-K127 HydrophobicContact CH2-CD 4.48Å; W122-K127 HydrophobicContact CH2-CG 4.23Å; W122-K127 HydrophobicContact CZ2-CD 3.92Å; W122-K127 HydrophobicContact CZ2-CG 4.08Å; W122-K127 HydrophobicContact CZ3-CG 4.43Å; S125-K127 PolarHBondContact O-N 3.35Å; S125-K127 PolarHBondContact OG-N 2.88Å; K127-A129 VanDerWaalsContact C-N 3.31Å; K127-A129 PolarHBondContact O-N 3.06Å
128	K	95.8	Very high	94.7	Very high	143 Å²	143	94.9 Å²	94.9	62%	0.622	43%	0.431	S	S	*	.			trans	-78.7	11.5	-179.7	-61	-63.9	-174.2	178.1	0	116.5	Y119 K126 F130 T131	Y119-K128 PolarHBondContact OH-N 2.92Å; K126-K128 HydrophobicContact CB-CG 4.05Å; K126-K128 PolarHBondContact O-N 3.07Å; K126-K128 VanDerWaalsContact O-N 3.1Å; K128-F130 PolarHBondContact O-N 2.88Å; K128-T131 HydrophobicContact CD-CG2 4.34Å; K128-T131 PolarHBondContact O-N 2.9Å; K128-T131 PolarHBondContact O-OG1 3.11Å; K128-T131 VanDerWaalsContact O-OG1 3.09Å
129	A	94.5	Very high	94.6	Very high	15 Å²	15	94.4 Å²	94.4	12%	0.124	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	132	179.5	0	0	0	0	0	110	F118 Y119 K127 T131	F118-A129 HydrophobicContact CB-CB 4.36Å; Y119-A129 HydrophobicContact CE2-CB 3.55Å; Y119-A129 PolarHBondContact OH-N 2.77Å; K127-A129 VanDerWaalsContact C-N 3.31Å; K127-A129 PolarHBondContact O-N 3.06Å; A129-T131 PolarHBondContact O-N 3Å; A129-T131 VanDerWaalsContact O-N 3.1Å
130	F	95.3	Very high	94.5	Very high	33 Å²	33	97.3 Å²	97.3	15%	0.145	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	-3.3	-176.8	-60.1	-87.3	0	0	0	116.9	F106 I110 K115 F118 K128 K132 Y133 C134	F106-F130 HydrophobicContact CB-CD1 4.35Å; F106-F130 HydrophobicContact CB-CE1 4.13Å; F106-F130 HydrophobicContact CD1-CD1 4.48Å; F106-F130 AromaticContact CD1-CE1 3.58Å; F106-F130 HydrophobicContact CD1-CE1 3.58Å; F106-F130 AromaticContact CD1-CZ 3.98Å; F106-F130 HydrophobicContact CD1-CZ 3.98Å; F106-F130 HydrophobicContact CD2-CD1 4.46Å; F106-F130 AromaticContact CD2-CE1 3.63Å; F106-F130 HydrophobicContact CD2-CE1 3.63Å; F106-F130 AromaticContact CE1-CE1 3.78Å; F106-F130 HydrophobicContact CE1-CE1 3.78Å; F106-F130 AromaticContact CE1-CZ 3.78Å; F106-F130 HydrophobicContact CE1-CZ 3.78Å; F106-F130 AromaticContact CE2-CE1 3.81Å; F106-F130 HydrophobicContact CE2-CE1 3.81Å; F106-F130 HydrophobicContact CE2-CZ 4.32Å; F106-F130 HydrophobicContact CG-CD1 4.2Å; F106-F130 AromaticContact CG-CE1 3.5Å; F106-F130 HydrophobicContact CG-CE1 3.5Å; F106-F130 HydrophobicContact CG-CZ 4.34Å; F106-F130 AromaticContact CZ-CE1 3.88Å; F106-F130 HydrophobicContact CZ-CE1 3.88Å; F106-F130 AromaticContact CZ-CZ 3.96Å; F106-F130 HydrophobicContact CZ-CZ 3.96Å; I110-F130 HydrophobicContact CD1-CB 3.95Å; I110-F130 HydrophobicContact CD1-CD1 3.42Å; I110-F130 VanDerWaalsContact CD1-CD1 3.42Å; I110-F130 HydrophobicContact CD1-CD2 3.83Å; I110-F130 HydrophobicContact CD1-CE1 3.8Å; I110-F130 HydrophobicContact CD1-CE2 4.18Å; I110-F130 HydrophobicContact CD1-CG 3.44Å; I110-F130 VanDerWaalsContact CD1-CG 3.44Å; I110-F130 HydrophobicContact CD1-CZ 4.16Å; K115-F130 HydrophobicContact CG-CD2 4.39Å; F118-F130 HydrophobicContact CD1-CE2 4.3Å; F118-F130 AromaticContact CD2-CE2 3.65Å; F118-F130 HydrophobicContact CD2-CE2 3.65Å; F118-F130 HydrophobicContact CD2-CZ 4.42Å; F118-F130 HydrophobicContact CE1-CE2 4.03Å; F118-F130 AromaticContact CE1-CZ 3.9Å; F118-F130 HydrophobicContact CE1-CZ 3.9Å; F118-F130 AromaticContact CE2-CE2 3.37Å; F118-F130 HydrophobicContact CE2-CE2 3.37Å; F118-F130 AromaticContact CE2-CZ 3.8Å; F118-F130 HydrophobicContact CE2-CZ 3.8Å; F118-F130 HydrophobicContact CG-CE2 4.12Å; F118-F130 AromaticContact CZ-CE2 3.57Å; F118-F130 HydrophobicContact CZ-CE2 3.57Å; F118-F130 AromaticContact CZ-CZ 3.49Å; F118-F130 HydrophobicContact CZ-CZ 3.49Å; F118-F130 VanDerWaalsContact CZ-CZ 3.49Å; K128-F130 PolarHBondContact O-N 2.88Å; F130-K132 VanDerWaalsContact C-N 3.29Å; F130-K132 PolarHBondContact O-N 3.33Å; F130-K132 VanDerWaalsContact O-N 3.15Å; F130-Y133 HydrophobicContact CD1-CG 4.49Å; F130-Y133 WeakPolarHBondContact O-CA 3.34Å; F130-Y133 PolarHBondContact O-N 2.77Å; F130-C134 PolarHBondContact O-N 3.36Å; F130-C134 PolarHBondContact O-SG 2.66Å
131	T	93	Very high	94.5	Very high	60 Å²	60	91.9 Å²	91.9	37%	0.368	43%	0.43	S	S	.	.	H	α-helix	trans	-58.7	-37	-174.8	57.8	0	0	0	0	113.9	K128 A129	K128-T131 HydrophobicContact CD-CG2 4.34Å; K128-T131 PolarHBondContact O-N 2.9Å; K128-T131 PolarHBondContact O-OG1 3.11Å; K128-T131 VanDerWaalsContact O-OG1 3.09Å; A129-T131 PolarHBondContact O-N 3Å; A129-T131 VanDerWaalsContact O-N 3.1Å
132	K	93.2	Very high	94.4	Very high	181 Å²	181	88.5 Å²	88.5	79%	0.787	41%	0.413	S	S	*	.	H	α-helix	trans	-77.3	-32.7	174.2	-66.8	-171.7	177.9	-172	0	112.5	F130	F130-K132 VanDerWaalsContact C-N 3.29Å; F130-K132 PolarHBondContact O-N 3.33Å; F130-K132 VanDerWaalsContact O-N 3.15Å
133	Y	93.7	Very high	94.4	Very high	46 Å²	46	91.5 Å²	91.5	18%	0.18	43%	0.427	C	S	.	.	H	α-helix	trans	-70.6	-46	-178.6	-170.7	-76	0	0	0	110.8	V105 F106 F130 K135 K136 W137	V105-Y133 WeakPolarHBondContact CA-OH 3.37Å; F106-Y133 HydrophobicContact CB-CD1 4.02Å; F106-Y133 HydrophobicContact CB-CE1 3.66Å; F106-Y133 PolarHBondContact N-OH 2.92Å; F106-Y133 VanDerWaalsContact N-OH 3.1Å; F106-Y133 WeakPolarHBondContact O-CE1 3.45Å; F130-Y133 HydrophobicContact CD1-CG 4.49Å; F130-Y133 WeakPolarHBondContact O-CA 3.34Å; F130-Y133 PolarHBondContact O-N 2.77Å; Y133-K135 PolarHBondContact O-N 2.73Å; Y133-K136 VanDerWaalsContact O-CB 3.23Å; Y133-K136 WeakPolarHBondContact O-CB 3.42Å; Y133-K136 WeakPolarHBondContact O-CG 3.47Å; Y133-K136 PolarHBondContact O-N 2.52Å; Y133-W137 AromaticContact CE1-NE1 3.92Å
134	C	91.9	Very high	94.4	Very high	21 Å²	21	91.6 Å²	91.6	14%	0.142	43%	0.425	C	S	.	.	H	α-helix	trans	-56.3	-37.2	179.1	-60	0	0	0	0	111.9	E108 F130 K136 W137	E108-C134 VanDerWaalsContact O-CB 3.31Å; E108-C134 WeakPolarHBondContact O-CB 3.17Å; E108-C134 PolarHBondContact O-SG 2.91Å; F130-C134 PolarHBondContact O-N 3.36Å; F130-C134 PolarHBondContact O-SG 2.66Å; C134-K136 PolarHBondContact O-N 2.79Å; C134-K136 VanDerWaalsContact O-N 3.14Å; C134-W137 PolarHBondContact O-N 2.96Å; C134-W137 VanDerWaalsContact O-N 3.12Å
135	K	92.9	Very high	94.4	Very high	143 Å²	143	86.2 Å²	86.2	62%	0.622	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-59.9	-23.2	176	-70.7	-174	174.9	-158.9	0	114.1	Y133 W137 Q138 D139	Y133-K135 PolarHBondContact O-N 2.73Å; K135-W137 PolarHBondContact O-N 3.33Å; K135-Q138 PolarHBondContact O-N 3.02Å; K135-Q138 VanDerWaalsContact O-N 3.08Å; K135-D139 PolarHBondContact O-N 3.13Å
136	K	93.4	Very high	94.4	Very high	83 Å²	83	85 Å²	85	36%	0.361	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-64.2	-23.7	176.6	-66.2	-171.9	170.8	-164.1	0	113.3	Y133 C134 G142 K143 L146	Y133-K136 VanDerWaalsContact O-CB 3.23Å; Y133-K136 WeakPolarHBondContact O-CB 3.42Å; Y133-K136 WeakPolarHBondContact O-CG 3.47Å; Y133-K136 PolarHBondContact O-N 2.52Å; C134-K136 PolarHBondContact O-N 2.79Å; C134-K136 VanDerWaalsContact O-N 3.14Å; K136-G142 CarbonylContact O-C 3.55Å; K136-G142 VanDerWaalsContact O-CA 3.23Å; K136-G142 WeakPolarHBondContact O-CA 3.29Å; K136-K143 PolarHBondContact O-N 3.4Å; K136-K143 VanDerWaalsContact O-N 3.12Å; K136-L146 HydrophobicContact CB-CD1 4.44Å
137	W	93.6	Very high	94.3	Very high	43 Å²	43	80 Å²	80	16%	0.163	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-75.7	-18.3	176.3	-70.5	96.3	0	0	0	112.5	V105 F106 E108 Y133 C134 K135 K143 L146 F150 L201	V105-W137 HydrophobicContact CG1-CH2 4.42Å; V105-W137 HydrophobicContact CG1-CZ2 3.91Å; F106-W137 WeakPolarHBondContact O-CZ2 3.35Å; F106-W137 PolarHBondContact O-NE1 2.75Å; E108-W137 VanDerWaalsContact CA-CD1 3.48Å; E108-W137 HydrophobicContact CB-CB 3.85Å; E108-W137 HydrophobicContact CB-CD2 4.23Å; E108-W137 HydrophobicContact CB-CG 3.67Å; E108-W137 HydrophobicContact CG-CB 3.75Å; E108-W137 HydrophobicContact CG-CG 4.1Å; Y133-W137 AromaticContact CE1-NE1 3.92Å; C134-W137 PolarHBondContact O-N 2.96Å; C134-W137 VanDerWaalsContact O-N 3.12Å; K135-W137 PolarHBondContact O-N 3.33Å; W137-K143 WeakPolarHBondContact O-CE 3.36Å; W137-L146 HydrophobicContact CD2-CD1 3.46Å; W137-L146 VanDerWaalsContact CD2-CD1 3.46Å; W137-L146 HydrophobicContact CE3-CD1 3.68Å; W137-L146 HydrophobicContact CG-CD1 3.9Å; W137-L146 HydrophobicContact CH2-CD1 4.22Å; W137-L146 HydrophobicContact CZ2-CD1 4.03Å; W137-L146 HydrophobicContact CZ2-CD2 4.12Å; W137-L146 HydrophobicContact CZ3-CD1 4.05Å; W137-F150 HydrophobicContact CH2-CE2 4.1Å; W137-F150 HydrophobicContact CH2-CZ 4.21Å; W137-L201 HydrophobicContact CH2-CD1 4.15Å; W137-L201 HydrophobicContact CZ2-CD1 4.35Å
138	Q	92.8	Very high	94.4	Very high	121 Å²	121	81.4 Å²	81.4	57%	0.565	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-38.3	-177.4	-61	178	-12	0	0	111.7	E108 K135 K143	E108-Q138 WeakPolarHBondContact OE1-CG 3.46Å; E108-Q138 PolarHBondContact OE1-NE2 3.4Å; K135-Q138 PolarHBondContact O-N 3.02Å; K135-Q138 VanDerWaalsContact O-N 3.08Å; Q138-K143 WeakPolarHBondContact O-CE 3.27Å; Q138-K143 PolarHBondContact O-NZ 3.13Å
139	D	93.3	Very high	94.4	Very high	90 Å²	90	75.5 Å²	75.5	48%	0.481	36%	0.355	S	S	.	.	S	Bend	trans	-73.9	138.5	177.8	-178.3	27.1	0	0	0	112.6	K135 D141 G142 K143	K135-D139 PolarHBondContact O-N 3.13Å; D139-D141 PolarHBondContact O-N 3.44Å; D139-G142 WeakPolarHBondContact O-CA 3.44Å; D139-G142 PolarHBondContact O-N 3.45Å; D139-K143 WeakPolarHBondContact O-CG 3.46Å; D139-K143 PolarHBondContact O-N 3.22Å
140	E	94.6	Very high	94.5	Very high	110 Å²	110	75 Å²	75	51%	0.514	35%	0.35	S	S	.	.	H	α-helix	trans	-64.4	-42.8	-176.5	-73.5	-57	123.7	0	0	112.2	G142 K143 K144	E140-G142 VanDerWaalsContact C-N 3.28Å; E140-G142 PolarHBondContact O-N 2.69Å; E140-K143 PolarHBondContact O-N 2.96Å; E140-K143 IonicContact OE1-NZ 2.79Å; E140-K143 PolarHBondContact OE1-NZ 3.02Å; E140-K144 WeakPolarHBondContact O-CG 3.18Å; E140-K144 PolarHBondContact O-N 3.14Å
141	D	95	Very high	94.6	Very high	108 Å²	108	76.9 Å²	76.9	58%	0.578	37%	0.368	S	S	*	.	H	α-helix	trans	-68.2	-33.1	176.1	-71.3	-23.5	0	0	0	111.6	D139 K144 Q145	D139-D141 PolarHBondContact O-N 3.44Å; D141-K144 IonicContact OD1-NZ 3.77Å; D141-Q145 WeakPolarHBondContact O-CB 3.33Å; D141-Q145 PolarHBondContact O-N 3.23Å
142	G	94.5	Very high	94.8	Very high	7 Å²	7	75.1 Å²	75.1	7%	0.072	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-46.6	172.1	0	0	0	0	0	112.8	K136 D139 E140 Q145 L146	K136-G142 CarbonylContact O-C 3.55Å; K136-G142 VanDerWaalsContact O-CA 3.23Å; K136-G142 WeakPolarHBondContact O-CA 3.29Å; D139-G142 WeakPolarHBondContact O-CA 3.44Å; D139-G142 PolarHBondContact O-N 3.45Å; E140-G142 VanDerWaalsContact C-N 3.28Å; E140-G142 PolarHBondContact O-N 2.69Å; G142-Q145 PolarHBondContact O-N 2.96Å; G142-L146 WeakPolarHBondContact O-CG 3.03Å; G142-L146 PolarHBondContact O-N 3.39Å
143	K	95.1	Very high	95	Very high	80 Å²	80	66.5 Å²	66.5	35%	0.348	32%	0.32	S	S	.	.	H	α-helix	trans	-62.3	-46	176.2	-70	172.6	-165.7	163.6	0	111.6	K136 W137 Q138 D139 E140 Q145 L146 E147	K136-K143 PolarHBondContact O-N 3.4Å; K136-K143 VanDerWaalsContact O-N 3.12Å; W137-K143 WeakPolarHBondContact O-CE 3.36Å; Q138-K143 WeakPolarHBondContact O-CE 3.27Å; Q138-K143 PolarHBondContact O-NZ 3.13Å; D139-K143 WeakPolarHBondContact O-CG 3.46Å; D139-K143 PolarHBondContact O-N 3.22Å; E140-K143 PolarHBondContact O-N 2.96Å; E140-K143 IonicContact OE1-NZ 2.79Å; E140-K143 PolarHBondContact OE1-NZ 3.02Å; K143-Q145 VanDerWaalsContact C-N 3.27Å; K143-Q145 PolarHBondContact O-N 2.89Å; K143-L146 WeakPolarHBondContact O-CB 3.46Å; K143-L146 PolarHBondContact O-N 3.03Å; K143-L146 VanDerWaalsContact O-N 3.1Å; K143-E147 PolarHBondContact O-N 2.61Å
144	K	96.2	Very high	95.2	Very high	135 Å²	135	68.1 Å²	68.1	59%	0.587	33%	0.328	S	S	*	.	H	α-helix	trans	-56.8	-42.3	174.6	-71	173.2	-171.7	165.7	0	111.8	E140 D141 E147 K148	E140-K144 WeakPolarHBondContact O-CG 3.18Å; E140-K144 PolarHBondContact O-N 3.14Å; D141-K144 IonicContact OD1-NZ 3.77Å; K144-E147 PolarHBondContact O-N 3.05Å; K144-K148 WeakPolarHBondContact O-CB 3.33Å; K144-K148 PolarHBondContact O-N 2.9Å
145	Q	95.3	Very high	95.4	Very high	72 Å²	72	74.5 Å²	74.5	34%	0.336	35%	0.354	S	S	.	.	H	α-helix	trans	-66.5	-38.7	176.9	-175.7	58.3	57	0	0	112.4	D141 G142 K143 K148 D149	D141-Q145 WeakPolarHBondContact O-CB 3.33Å; D141-Q145 PolarHBondContact O-N 3.23Å; G142-Q145 PolarHBondContact O-N 2.96Å; K143-Q145 VanDerWaalsContact C-N 3.27Å; K143-Q145 PolarHBondContact O-N 2.89Å; Q145-K148 PolarHBondContact O-N 2.97Å; Q145-D149 PolarHBondContact NE2-OD1 2.86Å; Q145-D149 WeakPolarHBondContact O-CB 3.38Å; Q145-D149 PolarHBondContact O-N 3.22Å
146	L	95.4	Very high	95.6	Very high	4 Å²	4	73 Å²	73	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	-63.5	-45.8	175.4	-72.3	165.8	0	0	0	111.4	V105 K136 W137 G142 K143 K148 D149 F150	V105-L146 HydrophobicContact CG1-CD2 3.77Å; K136-L146 HydrophobicContact CB-CD1 4.44Å; W137-L146 HydrophobicContact CD2-CD1 3.46Å; W137-L146 VanDerWaalsContact CD2-CD1 3.46Å; W137-L146 HydrophobicContact CE3-CD1 3.68Å; W137-L146 HydrophobicContact CG-CD1 3.9Å; W137-L146 HydrophobicContact CH2-CD1 4.22Å; W137-L146 HydrophobicContact CZ2-CD1 4.03Å; W137-L146 HydrophobicContact CZ2-CD2 4.12Å; W137-L146 HydrophobicContact CZ3-CD1 4.05Å; G142-L146 WeakPolarHBondContact O-CG 3.03Å; G142-L146 PolarHBondContact O-N 3.39Å; K143-L146 WeakPolarHBondContact O-CB 3.46Å; K143-L146 PolarHBondContact O-N 3.03Å; K143-L146 VanDerWaalsContact O-N 3.1Å; L146-K148 VanDerWaalsContact C-N 3.33Å; L146-K148 PolarHBondContact O-N 3.27Å; L146-D149 WeakPolarHBondContact O-CA 3.33Å; L146-D149 WeakPolarHBondContact O-CB 3.48Å; L146-D149 PolarHBondContact O-N 2.87Å; L146-D149 VanDerWaalsContact O-N 3.09Å; L146-F150 HydrophobicContact CB-CE2 4.47Å; L146-F150 WeakPolarHBondContact O-CD2 3.14Å; L146-F150 PolarHBondContact O-N 2.91Å
147	E	95.8	Very high	95.8	Very high	81 Å²	81	69.2 Å²	69.2	38%	0.379	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-38.9	175.8	-68.3	-54	150.9	0	0	112.5	K143 K144 D149 F150 S151 R198	K143-E147 PolarHBondContact O-N 2.61Å; K144-E147 PolarHBondContact O-N 3.05Å; E147-D149 VanDerWaalsContact C-N 3.31Å; E147-D149 PolarHBondContact O-N 3.33Å; E147-F150 PolarHBondContact O-N 3.05Å; E147-S151 WeakPolarHBondContact O-CB 3.14Å; E147-S151 PolarHBondContact O-N 3.07Å; E147-S151 PolarHBondContact O-OG 2.76Å; E147-R198 VanDerWaalsContact CD-NH1 3.35Å; E147-R198 IonicContact OE1-CZ 3.21Å; E147-R198 IonicContact OE1-NH1 3.51Å; E147-R198 PolarHBondContact OE1-NH1 2.72Å; E147-R198 IonicContact OE1-NH2 2.66Å; E147-R198 PolarHBondContact OE1-NH2 2.9Å; E147-R198 IonicContact OE2-CZ 4Å; E147-R198 IonicContact OE2-NH1 2.61Å; E147-R198 PolarHBondContact OE2-NH1 2.88Å
148	K	96.6	Very high	95.9	Very high	133 Å²	133	70.9 Å²	70.9	58%	0.578	34%	0.338	S	S	*	.	H	α-helix	trans	-62.2	-39.3	172.1	-175.7	175.7	-178.2	174.5	0	111.8	K144 Q145 L146 S152	K144-K148 WeakPolarHBondContact O-CB 3.33Å; K144-K148 PolarHBondContact O-N 2.9Å; Q145-K148 PolarHBondContact O-N 2.97Å; L146-K148 VanDerWaalsContact C-N 3.33Å; L146-K148 PolarHBondContact O-N 3.27Å; K148-S152 WeakPolarHBondContact O-CB 3.37Å; K148-S152 PolarHBondContact O-N 3.42Å; K148-S152 PolarHBondContact O-OG 2.86Å
149	D	96.7	Very high	96.2	Very high	19 Å²	19	66.1 Å²	66.1	10%	0.102	32%	0.318	C	S	.	.	H	α-helix	trans	-66.3	-45.9	177.2	-74.5	-5.6	0	0	0	111.3	K103 V105 Q145 L146 E147 S152 M153	K103-D149 HydrophobicContact CD-CB 3.9Å; K103-D149 WeakPolarHBondContact CE-OD1 3.2Å; K103-D149 IonicContact NZ-OD1 2.66Å; K103-D149 PolarHBondContact NZ-OD1 3.01Å; V105-D149 HydrophobicContact CG2-CB 4.16Å; Q145-D149 PolarHBondContact NE2-OD1 2.86Å; Q145-D149 WeakPolarHBondContact O-CB 3.38Å; Q145-D149 PolarHBondContact O-N 3.22Å; L146-D149 WeakPolarHBondContact O-CA 3.33Å; L146-D149 WeakPolarHBondContact O-CB 3.48Å; L146-D149 PolarHBondContact O-N 2.87Å; L146-D149 VanDerWaalsContact O-N 3.09Å; E147-D149 VanDerWaalsContact C-N 3.31Å; E147-D149 PolarHBondContact O-N 3.33Å; D149-S152 PolarHBondContact O-N 3.31Å; D149-M153 VanDerWaalsContact O-CG 3.29Å; D149-M153 WeakPolarHBondContact O-CG 3.34Å; D149-M153 PolarHBondContact O-N 3.27Å
150	F	96.6	Very high	96.4	Very high	4 Å²	4	61.9 Å²	61.9	2%	0.018	30%	0.295	C	S	.	.	H	α-helix	trans	-59.3	-48.3	173.6	-75.6	-63.1	0	0	0	111.8	I89 V105 W137 L146 E147 S152 M153 K154 L194 R198	I89-F150 HydrophobicContact CD1-CE1 4.02Å; V105-F150 HydrophobicContact CB-CE1 4.5Å; V105-F150 HydrophobicContact CB-CZ 4.38Å; V105-F150 HydrophobicContact CG1-CE1 4.32Å; V105-F150 HydrophobicContact CG1-CE2 4.21Å; V105-F150 HydrophobicContact CG1-CZ 3.73Å; V105-F150 HydrophobicContact CG2-CE1 4.47Å; W137-F150 HydrophobicContact CH2-CE2 4.1Å; W137-F150 HydrophobicContact CH2-CZ 4.21Å; L146-F150 HydrophobicContact CB-CE2 4.47Å; L146-F150 WeakPolarHBondContact O-CD2 3.14Å; L146-F150 PolarHBondContact O-N 2.91Å; E147-F150 PolarHBondContact O-N 3.05Å; F150-S152 VanDerWaalsContact C-N 3.31Å; F150-S152 PolarHBondContact O-N 2.82Å; F150-M153 WeakPolarHBondContact O-CA 3.09Å; F150-M153 WeakPolarHBondContact O-CB 3.43Å; F150-M153 PolarHBondContact O-N 3.01Å; F150-K154 PolarHBondContact O-N 3.2Å; F150-L194 HydrophobicContact CB-CD2 4.34Å; F150-L194 HydrophobicContact CD1-CD1 3.96Å; F150-L194 HydrophobicContact CD1-CD2 3.95Å; F150-L194 HydrophobicContact CD1-CG 4Å; F150-L194 HydrophobicContact CE1-CD1 4.21Å; F150-L194 WeakPolarHBondContact O-CD2 3.39Å; F150-R198 HydrophobicContact CE1-CB 4.35Å; F150-R198 HydrophobicContact CE1-CG 4.34Å; F150-R198 HydrophobicContact CZ-CG 4.08Å
151	S	97	Very high	96.6	Very high	74 Å²	74	58.5 Å²	58.5	52%	0.517	28%	0.277	S	S	.	.	H	α-helix	trans	-59	-42.9	177.7	-58.8	0	0	0	0	111.9	E147 M153 K154 K155	E147-S151 WeakPolarHBondContact O-CB 3.14Å; E147-S151 PolarHBondContact O-N 3.07Å; E147-S151 PolarHBondContact O-OG 2.76Å; S151-M153 VanDerWaalsContact C-N 3.32Å; S151-M153 PolarHBondContact O-N 3.18Å; S151-K154 PolarHBondContact O-N 2.81Å; S151-K155 PolarHBondContact O-N 3.04Å; S151-K155 VanDerWaalsContact O-N 3.1Å
152	S	97.2	Very high	96.8	Very high	23 Å²	23	53.3 Å²	53.3	16%	0.161	25%	0.25	C	C	.	.	H	α-helix	trans	-64.6	-37.5	175.5	-56.2	0	0	0	0	111.7	K148 D149 F150 K155 Y156	K148-S152 WeakPolarHBondContact O-CB 3.37Å; K148-S152 PolarHBondContact O-N 3.42Å; K148-S152 PolarHBondContact O-OG 2.86Å; D149-S152 PolarHBondContact O-N 3.31Å; F150-S152 VanDerWaalsContact C-N 3.31Å; F150-S152 PolarHBondContact O-N 2.82Å; S152-K155 PolarHBondContact O-N 3.01Å; S152-Y156 VanDerWaalsContact O-CD2 3.25Å; S152-Y156 WeakPolarHBondContact O-CD2 3.48Å; S152-Y156 PolarHBondContact O-N 2.69Å
153	M	97.8	Very high	97	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-66.2	-42.9	176.4	-74.5	174.2	60.2	0	0	111.9	I89 F102 K103 V105 D149 F150 S151 K155 C157 I160 L194	I89-M153 HydrophobicContact CB-CE 4.48Å; I89-M153 HydrophobicContact CG2-CE 3.83Å; F102-M153 HydrophobicContact CD1-CG 4.34Å; K103-M153 HydrophobicContact CB-CG 4.01Å; K103-M153 HydrophobicContact CB-SD 3.98Å; V105-M153 HydrophobicContact CG2-SD 4.06Å; D149-M153 VanDerWaalsContact O-CG 3.29Å; D149-M153 WeakPolarHBondContact O-CG 3.34Å; D149-M153 PolarHBondContact O-N 3.27Å; F150-M153 WeakPolarHBondContact O-CA 3.09Å; F150-M153 WeakPolarHBondContact O-CB 3.43Å; F150-M153 PolarHBondContact O-N 3.01Å; S151-M153 VanDerWaalsContact C-N 3.32Å; S151-M153 PolarHBondContact O-N 3.18Å; M153-K155 VanDerWaalsContact C-N 3.29Å; M153-K155 PolarHBondContact O-N 3.1Å; M153-C157 VanDerWaalsContact O-CB 3.23Å; M153-C157 WeakPolarHBondContact O-CB 2.7Å; M153-C157 PolarHBondContact O-N 2.94Å; M153-C157 VanDerWaalsContact O-N 3.12Å; M153-I160 HydrophobicContact CE-CD1 4.13Å; M153-L194 HydrophobicContact CB-CD2 3.78Å; M153-L194 HydrophobicContact CE-CD1 3.63Å
154	K	97	Very high	97.1	Very high	79 Å²	79	50 Å²	50	34%	0.343	23%	0.234	S	C	.	.	H	α-helix	trans	-59	-40.7	174.1	-63.7	-167.4	-177.9	-170.4	0	112	F150 S151 A191 L194 D195	F150-K154 PolarHBondContact O-N 3.2Å; S151-K154 PolarHBondContact O-N 2.81Å; K154-A191 HydrophobicContact CD-CB 4Å; K154-A191 HydrophobicContact CG-CB 4.41Å; K154-L194 HydrophobicContact CD-CD2 4.42Å; K154-L194 HydrophobicContact CG-CD2 3.46Å; K154-L194 VanDerWaalsContact CG-CD2 3.46Å; K154-D195 WeakPolarHBondContact CE-OD1 3.38Å; K154-D195 IonicContact NZ-OD1 2.59Å; K154-D195 PolarHBondContact NZ-OD1 3.02Å; K154-D195 IonicContact NZ-OD2 3.78Å; K154-D195 PolarHBondContact NZ-OD2 2.88Å
155	K	97	Very high	97.2	Very high	156 Å²	156	43.6 Å²	43.6	68%	0.678	21%	0.206	S	C	*	.	H	α-helix	trans	-74.8	-44.2	-176.2	-174.8	172.5	-179.3	177.6	0	114.1	S151 S152 M153	S151-K155 PolarHBondContact O-N 3.04Å; S151-K155 VanDerWaalsContact O-N 3.1Å; S152-K155 PolarHBondContact O-N 3.01Å; M153-K155 VanDerWaalsContact C-N 3.29Å; M153-K155 PolarHBondContact O-N 3.1Å
156	Y	96.9	Very high	97.3	Very high	110 Å²	110	40.2 Å²	40.2	43%	0.431	19%	0.19	S	C	.	.	H	α-helix	trans	-107.8	-22.9	-166	-63.4	-66.5	0	0	0	115	V93 F102 S152 Q158	V93-Y156 WeakPolarHBondContact CG2-O 3.34Å; F102-Y156 HydrophobicContact CE1-CD2 4.13Å; F102-Y156 HydrophobicContact CE2-CD2 4.43Å; F102-Y156 AromaticContact CZ-CD2 3.63Å; F102-Y156 HydrophobicContact CZ-CD2 3.63Å; F102-Y156 HydrophobicContact CZ-CE2 4.49Å; F102-Y156 HydrophobicContact CZ-CG 4.11Å; S152-Y156 VanDerWaalsContact O-CD2 3.25Å; S152-Y156 WeakPolarHBondContact O-CD2 3.48Å; S152-Y156 PolarHBondContact O-N 2.69Å; Y156-Q158 PolarHBondContact O-NE2 2.74Å; Y156-Q158 PolarHBondContact O-OE1 3.47Å
157	C	97.3	Very high	97.4	Very high	4 Å²	4	40.1 Å²	40.1	3%	0.027	19%	0.19	C	C	.	.			trans	-85.3	143.4	-174	-61.4	0	0	0	0	111.5	G91 Y92 F102 M153 I160 V190	G91-C157 VanDerWaalsContact CA-SG 3.53Å; Y92-C157 WeakPolarHBondContact O-CA 3.41Å; Y92-C157 WeakPolarHBondContact O-CB 3.46Å; F102-C157 VanDerWaalsContact CD1-SG 3.57Å; M153-C157 VanDerWaalsContact O-CB 3.23Å; M153-C157 WeakPolarHBondContact O-CB 2.7Å; M153-C157 PolarHBondContact O-N 2.94Å; M153-C157 VanDerWaalsContact O-N 3.12Å; C157-I160 HydrophobicContact CB-CD1 3.97Å; C157-V190 WeakPolarHBondContact O-CG1 3.46Å
158	Q	96.5	Very high	97.5	Very high	78 Å²	78	36.4 Å²	36.4	36%	0.364	17%	0.172	S	C	.	.	S	Bend	trans	-100.5	-26.2	172.5	-68.7	68.8	30.7	0	0	110.8	Y92 V93 E94 Y156	Y92-Q158 PolarHBondContact O-N 3.29Å; V93-Q158 VanDerWaalsContact CA-OE1 3.28Å; E94-Q158 HydrophobicContact CB-CG 4.2Å; Y156-Q158 PolarHBondContact O-NE2 2.74Å; Y156-Q158 PolarHBondContact O-OE1 3.47Å
159	V	98	Very high	97.5	Very high	22 Å²	22	38.8 Å²	38.8	13%	0.133	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.9	-177.3	177	0	0	0	0	110.2	Y92 L99 R161 Q184	Y92-V159 PolarHBondContact N-O 3.24Å; Y92-V159 PolarHBondContact O-N 3.3Å; L99-V159 HydrophobicContact CD1-CG2 4.17Å; L99-V159 HydrophobicContact CD2-CG2 4.31Å; V159-R161 HydrophobicContact CG1-CG 4.14Å; V159-Q184 HydrophobicContact CG1-CG 3.76Å
160	I	98.5	Very high	97.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.4	172.7	-58.1	-56.1	0	0	0	109.4	I89 M153 C157 V185 V190 K193 L194 A197	I89-I160 HydrophobicContact CG2-CG2 3.69Å; M153-I160 HydrophobicContact CE-CD1 4.13Å; C157-I160 HydrophobicContact CB-CD1 3.97Å; I160-V185 HydrophobicContact CG2-CG2 4.44Å; I160-V185 PolarHBondContact O-N 3.26Å; I160-V190 HydrophobicContact CD1-CG1 4.19Å; I160-V190 HydrophobicContact CG1-CG1 4.05Å; I160-K193 HydrophobicContact CB-CB 4.1Å; I160-K193 HydrophobicContact CG1-CB 4.15Å; I160-L194 HydrophobicContact CD1-CD1 4.44Å; I160-L194 HydrophobicContact CG2-CD1 4.44Å; I160-A197 HydrophobicContact CG2-CB 4.47Å
161	R	98.6	Very high	97.4	Very high	39 Å²	39	41 Å²	41	15%	0.147	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136.8	172.7	-54.4	-158.3	173.1	141.1	3.6	110.7	I89 V90 Y92 V159 E182 I183 Q184	I89-R161 CarbonylContact C-O 3.52Å; I89-R161 WeakPolarHBondContact CA-O 3.43Å; V90-R161 PolarHBondContact N-O 3.09Å; V90-R161 PolarHBondContact O-N 3.38Å; Y92-R161 HydrophobicContact CD2-CG 4.06Å; Y92-R161 HydrophobicContact CE2-CB 4.43Å; Y92-R161 HydrophobicContact CE2-CG 3.93Å; V159-R161 HydrophobicContact CG1-CG 4.14Å; R161-E182 HydrophobicContact CB-CB 4.18Å; R161-E182 IonicContact NH1-OE2 2.75Å; R161-I183 CarbonylContact C-O 3.46Å; R161-I183 WeakPolarHBondContact CA-O 3.28Å; R161-I183 WeakPolarHBondContact CB-O 3.14Å; R161-Q184 HydrophobicContact CG-CB 4.2Å; R161-Q184 HydrophobicContact CG-CG 4.3Å
162	V	98.5	Very high	97.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	140.8	167.7	-65.7	0	0	0	0	110.1	L43 V86 G88 E182 I183 V185 A197	L43-V162 HydrophobicContact CD2-CG2 3.55Å; V86-V162 HydrophobicContact CG1-CB 3.91Å; V86-V162 HydrophobicContact CG1-CG1 4.08Å; V86-V162 HydrophobicContact CG2-CG2 4.48Å; G88-V162 CarbonylContact O-C 3.5Å; G88-V162 WeakPolarHBondContact O-CA 3.49Å; V162-E182 CarbonylContact O-C 3.49Å; V162-E182 WeakPolarHBondContact O-CA 3.5Å; V162-I183 HydrophobicContact CG2-CB 3.94Å; V162-I183 PolarHBondContact N-O 3.08Å; V162-I183 PolarHBondContact O-N 2.88Å; V162-V185 HydrophobicContact CG1-CG2 3.85Å; V162-V185 HydrophobicContact CG2-CG2 4.47Å; V162-A197 HydrophobicContact CG1-CB 3.62Å
163	I	98.4	Very high	97.3	Very high	17 Å²	17	40.5 Å²	40.5	9%	0.087	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	115.8	165.9	-60.3	172.7	0	0	0	106.7	V87 G88 V90 T104 F106 L180 M181 E182	V87-I163 HydrophobicContact CG2-CB 4.43Å; V87-I163 HydrophobicContact CG2-CG2 3.88Å; V87-I163 WeakPolarHBondContact CG2-O 3.48Å; V87-I163 PolarHBondContact N-O 3.44Å; G88-I163 PolarHBondContact N-O 2.95Å; G88-I163 PolarHBondContact O-N 3.04Å; V90-I163 HydrophobicContact CG2-CD1 3.48Å; V90-I163 VanDerWaalsContact CG2-CD1 3.48Å; V90-I163 HydrophobicContact CG2-CG1 3.59Å; T104-I163 HydrophobicContact CG2-CD1 3.73Å; F106-I163 HydrophobicContact CE1-CD1 3.75Å; F106-I163 HydrophobicContact CZ-CD1 3.86Å; I163-L180 HydrophobicContact CG2-CD2 3.59Å; I163-M181 WeakPolarHBondContact CA-O 3.01Å; I163-E182 HydrophobicContact CG1-CG 4.16Å
164	A	98.4	Very high	97.2	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146.5	178.3	0	0	0	0	0	111.4	M84 V85 V86 M181 I183	M84-A164 HydrophobicContact CB-CB 4.44Å; M84-A164 HydrophobicContact CE-CB 3.59Å; V85-A164 CarbonylContact O-C 3.54Å; V85-A164 WeakPolarHBondContact O-CA 3.45Å; V86-A164 HydrophobicContact CG2-CB 4.27Å; A164-M181 PolarHBondContact N-O 2.73Å; A164-M181 PolarHBondContact O-N 2.85Å; A164-I183 HydrophobicContact CB-CD1 3.91Å
165	H	98.2	Very high	97.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	154.5	175.3	74.4	84.2	0	0	0	112.8	M84 V85 V87 S111 E113 A178 H179 L180	M84-H165 CarbonylContact C-O 3.05Å; M84-H165 WeakPolarHBondContact CA-O 3.02Å; M84-H165 WeakPolarHBondContact CB-O 3.39Å; V85-H165 PolarHBondContact N-O 3.11Å; V85-H165 PolarHBondContact O-N 3.1Å; V87-H165 WeakPolarHBondContact CG1-CD2 3.42Å; S111-H165 PolarHBondContact OG-CE1 2.93Å; S111-H165 PolarHBondContact OG-NE2 3.42Å; E113-H165 IonicContact OE1-CE1 3.52Å; E113-H165 IonicContact OE1-ND1 3.85Å; H165-A178 HydrophobicContact CB-CB 4.01Å; H165-H179 VanDerWaalsContact CA-O 3.3Å; H165-H179 WeakPolarHBondContact CA-O 3.34Å; H165-L180 HydrophobicContact CB-CD2 3.59Å; H165-L180 HydrophobicContact CB-CG 4.03Å
166	T	98.1	Very high	97.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	22%	0.223	C	C	.	.			trans	-79	153.8	170.5	40.3	0	0	0	0	111.3	L47 Y49 M84 A178 H179	L47-T166 HydrophobicContact CB-CG2 3.42Å; L47-T166 VanDerWaalsContact CB-CG2 3.42Å; L47-T166 HydrophobicContact CD1-CG2 3.88Å; L47-T166 HydrophobicContact CG-CG2 4.22Å; Y49-T166 HydrophobicContact CE2-CG2 3.81Å; Y49-T166 VanDerWaalsContact OH-CB 3.28Å; Y49-T166 WeakPolarHBondContact OH-CB 3.4Å; Y49-T166 WeakPolarHBondContact OH-CG2 3.49Å; Y49-T166 PolarHBondContact OH-OG1 3.26Å; M84-T166 HydrophobicContact CG-CG2 4.2Å; T166-A178 WeakPolarHBondContact O-CB 3.43Å; T166-H179 PolarHBondContact N-O 2.98Å; T166-H179 VanDerWaalsContact N-O 3.14Å; T166-H179 WeakPolarHBondContact OG1-CB 3.36Å; T166-H179 PolarHBondContact OG1-N 2.74Å; T166-H179 PolarHBondContact OG1-O 3.27Å
167	Q	97.4	Very high	97.1	Very high	3 Å²	3	48.9 Å²	48.9	1%	0.014	22%	0.215	C	C	.	.			trans	-96.4	100.2	172.9	-64.1	-175	76.5	0	0	110.6	P83 V85 E113 R169 L170 Q204	P83-Q167 PolarHBondContact O-NE2 2.99Å; V85-Q167 HydrophobicContact CG2-CG 3.95Å; E113-Q167 VanDerWaalsContact OE1-CA 3.27Å; E113-Q167 WeakPolarHBondContact OE1-CA 3.4Å; E113-Q167 WeakPolarHBondContact OE1-CG 3.33Å; Q167-R169 VanDerWaalsContact OE1-NH2 3.11Å; Q167-L170 HydrophobicContact CB-CD1 3.75Å; Q167-L170 HydrophobicContact CB-CG 3.96Å; Q167-L170 HydrophobicContact CG-CD1 4.46Å; Q167-Q204 VanDerWaalsContact NE2-CD 3.28Å
168	M	96.9	Very high	97.1	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.01	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-75.8	-28.1	-174.3	-69.5	-64.4	-41.4	0	0	112.7	Y49 E113 L170 L171 L173 Q175	Y49-M168 HydrophobicContact CE1-CE 4.23Å; Y49-M168 HydrophobicContact CE1-SD 3.9Å; Y49-M168 PolarHBondContact OH-SD 2.66Å; E113-M168 PolarHBondContact OE2-N 3.35Å; M168-L170 PolarHBondContact O-N 3.33Å; M168-L171 HydrophobicContact CE-CD1 3.97Å; M168-L171 PolarHBondContact O-N 2.87Å; M168-L171 VanDerWaalsContact O-N 3.13Å; M168-L171 HydrophobicContact SD-CD1 4.14Å; M168-L173 HydrophobicContact CE-CB 4.19Å; M168-L173 HydrophobicContact CE-CD1 3.97Å; M168-Q175 WeakPolarHBondContact CB-O 3.39Å; M168-Q175 HydrophobicContact CE-CB 3.94Å; M168-Q175 HydrophobicContact CE-CG 4.01Å; M168-Q175 WeakPolarHBondContact CE-O 3.5Å
169	R	95.8	Very high	97.2	Very high	184 Å²	184	45.6 Å²	45.6	69%	0.694	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-59.3	-24	176.9	63.6	178.3	176.5	166.7	0.4	113.4	E113 Q167 L171	E113-R169 PolarHBondContact OE2-N 3.21Å; Q167-R169 VanDerWaalsContact OE1-NH2 3.11Å; R169-L171 VanDerWaalsContact C-N 3.34Å
170	L	96.3	Very high	97.1	Very high	58 Å²	58	46 Å²	46	30%	0.304	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-84.3	-9.2	-179.1	-58.3	-177.8	0	0	0	113	P82 P83 Q167 M168 N328	P82-L170 HydrophobicContact CB-CB 4.25Å; P82-L170 HydrophobicContact CB-CD1 4.13Å; P83-L170 HydrophobicContact CG-CD1 4.45Å; Q167-L170 HydrophobicContact CB-CD1 3.75Å; Q167-L170 HydrophobicContact CB-CG 3.96Å; Q167-L170 HydrophobicContact CG-CD1 4.46Å; M168-L170 PolarHBondContact O-N 3.33Å; L170-N328 PolarHBondContact O-ND2 3.21Å
171	L	96.6	Very high	97.1	Very high	12 Å²	12	46.3 Å²	46.3	6%	0.063	20%	0.202	C	C	.	.	S	Bend	trans	-101.5	149.7	-176.9	-66.5	166.5	0	0	0	110.8	Y49 E80 P82 M168 R169 L173	Y49-L171 HydrophobicContact CD1-CD1 4.01Å; Y49-L171 HydrophobicContact CD2-CD1 3.34Å; Y49-L171 HydrophobicContact CD2-CD2 4.16Å; Y49-L171 HydrophobicContact CD2-CG 4.4Å; Y49-L171 HydrophobicContact CE1-CD1 3.97Å; Y49-L171 HydrophobicContact CE2-CD1 3.32Å; Y49-L171 HydrophobicContact CG-CD1 3.71Å; Y49-L171 HydrophobicContact CG-CD2 4.48Å; E80-L171 HydrophobicContact CB-CD2 4.42Å; E80-L171 HydrophobicContact CG-CD2 3.88Å; E80-L171 VanDerWaalsContact OE2-CD2 3.3Å; E80-L171 WeakPolarHBondContact OE2-CD2 3.36Å; P82-L171 HydrophobicContact CG-CD1 4.08Å; P82-L171 HydrophobicContact CG-CD2 3.39Å; P82-L171 HydrophobicContact CG-CG 3.64Å; M168-L171 HydrophobicContact CE-CD1 3.97Å; M168-L171 PolarHBondContact O-N 2.87Å; M168-L171 VanDerWaalsContact O-N 3.13Å; M168-L171 HydrophobicContact SD-CD1 4.14Å; R169-L171 VanDerWaalsContact C-N 3.34Å; L171-L173 HydrophobicContact CB-CB 4.33Å; L171-L173 HydrophobicContact CB-CD1 4.14Å; L171-L173 HydrophobicContact CB-CG 3.99Å; L171-L173 HydrophobicContact CD1-CD1 4.09Å; L171-L173 PolarHBondContact O-N 2.81Å
172	P	94.5	Very high	97.1	Very high	58 Å²	58	47.7 Å²	47.7	38%	0.377	21%	0.21	S	C	.	.	S	Bend	trans	-75.6	44.3	175	34.2	-38.7	0	0	0	112.4	Y323	P172-Y323 HydrophobicContact CG-CD1 4.29Å; P172-Y323 HydrophobicContact CG-CE1 3.96Å
173	L	95.8	Very high	97.1	Very high	27 Å²	27	47.8 Å²	47.8	14%	0.141	21%	0.211	C	C	.	.	S	Bend	trans	-120.3	140.6	-174.1	-57.7	-179.2	0	0	0	110.8	Y49 M168 L171 Q175 Y323 K342	Y49-L173 HydrophobicContact CD1-CD1 3.97Å; Y49-L173 HydrophobicContact CE1-CD1 4.44Å; M168-L173 HydrophobicContact CE-CB 4.19Å; M168-L173 HydrophobicContact CE-CD1 3.97Å; L171-L173 HydrophobicContact CB-CB 4.33Å; L171-L173 HydrophobicContact CB-CD1 4.14Å; L171-L173 HydrophobicContact CB-CG 3.99Å; L171-L173 HydrophobicContact CD1-CD1 4.09Å; L171-L173 PolarHBondContact O-N 2.81Å; L173-Q175 PolarHBondContact O-N 2.78Å; L173-Q175 VanDerWaalsContact O-N 3.15Å; L173-Y323 HydrophobicContact CD2-CE2 4.31Å; L173-K342 HydrophobicContact CD2-CB 3.78Å; L173-K342 HydrophobicContact CD2-CD 3.6Å; L173-K342 HydrophobicContact CD2-CG 3.56Å
174	R	95.9	Very high	97.1	Very high	254 Å²	254	47.9 Å²	47.9	96%	0.958	21%	0.211	S	C	*	.	S	Bend	trans	-65.1	-18.7	178.5	-63.2	-176.3	179.5	-179.8	-1.6	114	K176	R174-K176 PolarHBondContact O-N 2.88Å
175	Q	96	Very high	97.1	Very high	75 Å²	75	47.9 Å²	47.9	35%	0.35	21%	0.211	S	C	.	.			trans	-75.7	123	-176.2	171.1	176.1	-19.8	0	0	110.4	M168 L173 K177 H179	M168-Q175 WeakPolarHBondContact CB-O 3.39Å; M168-Q175 HydrophobicContact CE-CB 3.94Å; M168-Q175 HydrophobicContact CE-CG 4.01Å; M168-Q175 WeakPolarHBondContact CE-O 3.5Å; L173-Q175 PolarHBondContact O-N 2.78Å; L173-Q175 VanDerWaalsContact O-N 3.15Å; Q175-K177 HydrophobicContact CG-CB 4.27Å; Q175-K177 PolarHBondContact NE2-O 2.83Å; Q175-H179 PolarHBondContact NE2-CE1 3.33Å; Q175-H179 PolarHBondContact NE2-NE2 3.14Å
176	K	96.6	Very high	97.1	Very high	134 Å²	134	48 Å²	48	58%	0.583	21%	0.211	S	C	*	.			trans	-95.2	-5.3	175.7	-57	-175.3	178.9	-174.7	0	114.4	E113 R116 R174	E113-K176 WeakPolarHBondContact CB-O 3.09Å; R116-K176 WeakPolarHBondContact CD-O 3.46Å; R174-K176 PolarHBondContact O-N 2.88Å
177	K	97	Very high	97.1	Very high	59 Å²	59	48 Å²	48	26%	0.257	21%	0.211	S	C	.	.	S	Bend	trans	-92.3	110.2	-171.6	-174.6	175.4	-174	157.6	0	110.5	R116 R117 Y119 Q175	R116-K177 HydrophobicContact CB-CB 4.34Å; R116-K177 HydrophobicContact CB-CG 4.14Å; R116-K177 WeakPolarHBondContact O-CE 3.3Å; R116-K177 PolarHBondContact O-NZ 3.18Å; R117-K177 PolarHBondContact NH2-O 2.81Å; R117-K177 WeakPolarHBondContact O-CE 3.46Å; R117-K177 PolarHBondContact O-NZ 3.34Å; R117-K177 VanDerWaalsContact O-NZ 3.16Å; Y119-K177 PolarHBondContact O-NZ 3.32Å; Q175-K177 HydrophobicContact CG-CB 4.27Å; Q175-K177 PolarHBondContact NE2-O 2.83Å
178	A	97.7	Very high	97.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-62.9	138.2	-177.1	0	0	0	0	0	113.2	E113 R117 H165 T166	E113-A178 HydrophobicContact CB-CB 4.11Å; E113-A178 HydrophobicContact CG-CB 4.06Å; E113-A178 VanDerWaalsContact O-CB 3.24Å; E113-A178 WeakPolarHBondContact O-CB 3.41Å; E113-A178 PolarHBondContact O-N 2.92Å; R117-A178 PolarHBondContact NE-O 3.44Å; R117-A178 PolarHBondContact NH2-O 3.19Å; H165-A178 HydrophobicContact CB-CB 4.01Å; T166-A178 WeakPolarHBondContact O-CB 3.43Å
179	H	98.2	Very high	97.1	Very high	13 Å²	13	51.3 Å²	51.3	6%	0.06	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-81	118.2	173.5	-63.4	98.5	0	0	0	110.2	L47 Y49 R117 H165 T166 Q175 V344	L47-H179 HydrophobicContact CD1-CB 3.89Å; Y49-H179 AromaticContact CE1-CE1 3.82Å; Y49-H179 AromaticContact CE1-ND1 3.71Å; Y49-H179 AromaticContact CZ-ND1 3.65Å; Y49-H179 PolarHBondContact OH-ND1 3Å; R117-H179 PolarHBondContact NH2-CD2 3.1Å; H165-H179 VanDerWaalsContact CA-O 3.3Å; H165-H179 WeakPolarHBondContact CA-O 3.34Å; T166-H179 PolarHBondContact N-O 2.98Å; T166-H179 VanDerWaalsContact N-O 3.14Å; T166-H179 WeakPolarHBondContact OG1-CB 3.36Å; T166-H179 PolarHBondContact OG1-N 2.74Å; T166-H179 PolarHBondContact OG1-O 3.27Å; Q175-H179 PolarHBondContact NE2-CE1 3.33Å; Q175-H179 PolarHBondContact NE2-NE2 3.14Å; H179-V344 HydrophobicContact CB-CG2 4.44Å
180	L	96.5	Very high	97.2	Very high	30 Å²	30	44.1 Å²	44.1	16%	0.157	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	122.1	-178.8	-90	174.6	0	0	0	112.5	R26 V87 R117 F118 I163 H165	R26-L180 PolarHBondContact NH1-O 3.13Å; R26-L180 PolarHBondContact NH2-O 2.92Å; V87-L180 HydrophobicContact CG2-CD2 3.92Å; R117-L180 HydrophobicContact CB-CD1 3.71Å; R117-L180 HydrophobicContact CB-CG 4.41Å; R117-L180 HydrophobicContact CG-CB 4.32Å; R117-L180 HydrophobicContact CG-CD1 3.75Å; R117-L180 HydrophobicContact CG-CG 4.32Å; F118-L180 HydrophobicContact CE2-CD1 3.7Å; F118-L180 HydrophobicContact CZ-CD1 3.82Å; I163-L180 HydrophobicContact CG2-CD2 3.59Å; H165-L180 HydrophobicContact CB-CD2 3.59Å; H165-L180 HydrophobicContact CB-CG 4.03Å
181	M	97.6	Very high	97.2	Very high	7 Å²	7	43 Å²	43	3%	0.034	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	153.2	173	72.8	174.1	-68	0	0	112.2	R26 V29 A45 L47 M84 I163 A164 I183 T346	R26-M181 VanDerWaalsContact CZ-CB 3.5Å; V29-M181 HydrophobicContact CG2-CE 3.88Å; A45-M181 HydrophobicContact CB-CE 3.73Å; L47-M181 HydrophobicContact CD1-CB 4.28Å; L47-M181 HydrophobicContact CD1-CG 4Å; L47-M181 HydrophobicContact CD1-SD 3.99Å; L47-M181 HydrophobicContact CD2-CG 4.35Å; L47-M181 HydrophobicContact CD2-SD 3.31Å; L47-M181 WeakPolarHBondContact CD2-SD 3.43Å; L47-M181 HydrophobicContact CG-CG 4.05Å; L47-M181 HydrophobicContact CG-SD 3.39Å; L47-M181 WeakPolarHBondContact CG-SD 3.02Å; M84-M181 HydrophobicContact CE-CG 3.87Å; M84-M181 HydrophobicContact CE-SD 4.22Å; I163-M181 WeakPolarHBondContact CA-O 3.01Å; A164-M181 PolarHBondContact N-O 2.73Å; A164-M181 PolarHBondContact O-N 2.85Å; M181-I183 HydrophobicContact CE-CG1 3.65Å; M181-I183 HydrophobicContact CG-CD1 4.31Å; M181-I183 HydrophobicContact CG-CG1 3.84Å; M181-I183 HydrophobicContact SD-CD1 4.3Å; M181-I183 HydrophobicContact SD-CG1 3.8Å; M181-T346 HydrophobicContact CE-CG2 3.76Å; M181-T346 HydrophobicContact SD-CG2 4.14Å
182	E	98.2	Very high	97.3	Very high	68 Å²	68	47 Å²	47	32%	0.318	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	136.7	159.4	-69.1	162.8	-134	0	0	109	F32 V90 Y92 R161 V162 I163	F32-E182 WeakPolarHBondContact CZ-O 3.4Å; V90-E182 HydrophobicContact CG2-CG 4.46Å; Y92-E182 WeakPolarHBondContact CE2-OE2 3.49Å; Y92-E182 PolarHBondContact OH-OE1 2.73Å; Y92-E182 PolarHBondContact OH-OE2 3.19Å; R161-E182 HydrophobicContact CB-CB 4.18Å; R161-E182 IonicContact NH1-OE2 2.75Å; V162-E182 CarbonylContact O-C 3.49Å; V162-E182 WeakPolarHBondContact O-CA 3.5Å; I163-E182 HydrophobicContact CG1-CG 4.16Å
183	I	98.5	Very high	97.5	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.4	171.1	-57.7	160.7	0	0	0	107	L43 A45 M84 R161 V162 A164 M181	L43-I183 HydrophobicContact CB-CG2 3.97Å; L43-I183 HydrophobicContact CD1-CD1 4.48Å; L43-I183 HydrophobicContact CD2-CB 4.42Å; L43-I183 HydrophobicContact CD2-CG2 3.94Å; L43-I183 HydrophobicContact CG-CG2 4.41Å; A45-I183 HydrophobicContact CB-CG1 4.37Å; A45-I183 HydrophobicContact CB-CG2 4.06Å; A45-I183 VanDerWaalsContact O-CD1 3.3Å; A45-I183 WeakPolarHBondContact O-CD1 3.3Å; M84-I183 HydrophobicContact CE-CD1 3.94Å; M84-I183 HydrophobicContact SD-CD1 4.4Å; R161-I183 CarbonylContact C-O 3.46Å; R161-I183 WeakPolarHBondContact CA-O 3.28Å; R161-I183 WeakPolarHBondContact CB-O 3.14Å; V162-I183 HydrophobicContact CG2-CB 3.94Å; V162-I183 PolarHBondContact N-O 3.08Å; V162-I183 PolarHBondContact O-N 2.88Å; A164-I183 HydrophobicContact CB-CD1 3.91Å; M181-I183 HydrophobicContact CE-CG1 3.65Å; M181-I183 HydrophobicContact CG-CD1 4.31Å; M181-I183 HydrophobicContact CG-CG1 3.84Å; M181-I183 HydrophobicContact SD-CD1 4.3Å; M181-I183 HydrophobicContact SD-CG1 3.8Å
184	Q	98.6	Very high	97.5	Very high	18 Å²	18	43.2 Å²	43.2	8%	0.084	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	132.5	176.7	-167.7	172.3	-58.8	0	0	110.4	F32 T44 V159 R161 N186	F32-Q184 HydrophobicContact CB-CB 3.89Å; F32-Q184 HydrophobicContact CB-CG 4.44Å; F32-Q184 HydrophobicContact CD1-CB 3.71Å; F32-Q184 HydrophobicContact CD2-CB 3.81Å; F32-Q184 HydrophobicContact CE1-CB 4.14Å; F32-Q184 HydrophobicContact CE2-CB 4.24Å; F32-Q184 HydrophobicContact CG-CB 3.52Å; F32-Q184 HydrophobicContact CG-CG 4.48Å; F32-Q184 HydrophobicContact CZ-CB 4.38Å; T44-Q184 WeakPolarHBondContact CG2-O 3.5Å; T44-Q184 PolarHBondContact N-O 3.21Å; T44-Q184 PolarHBondContact OG1-O 3.24Å; V159-Q184 HydrophobicContact CG1-CG 3.76Å; R161-Q184 HydrophobicContact CG-CB 4.2Å; R161-Q184 HydrophobicContact CG-CG 4.3Å; Q184-N186 WeakPolarHBondContact CG-OD1 3.21Å; Q184-N186 PolarHBondContact NE2-OD1 2.67Å
185	V	98.5	Very high	97.6	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	121.9	172.1	-171.1	0	0	0	0	106.8	V41 L43 I160 V162 K193 W196	V41-V185 HydrophobicContact CG1-CG1 3.28Å; L43-V185 HydrophobicContact CD2-CG2 4.09Å; I160-V185 HydrophobicContact CG2-CG2 4.44Å; I160-V185 PolarHBondContact O-N 3.26Å; V162-V185 HydrophobicContact CG1-CG2 3.85Å; V162-V185 HydrophobicContact CG2-CG2 4.47Å; V185-K193 HydrophobicContact CB-CB 4.4Å; V185-K193 HydrophobicContact CB-CG 4.44Å; V185-K193 HydrophobicContact CG1-CB 4.04Å; V185-K193 HydrophobicContact CG1-CG 3.95Å; V185-W196 HydrophobicContact CG1-CE3 4.03Å; V185-W196 HydrophobicContact CG1-CZ3 4.39Å; V185-W196 HydrophobicContact CG2-CE3 4.49Å; V185-W196 HydrophobicContact CG2-CZ3 4.38Å
186	N	98.2	Very high	97.7	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	162	177.9	-77.4	14.1	0	0	0	109.6	P33 K34 D35 V41 H42 T44 Q184	P33-N186 PolarHBondContact O-ND2 2.85Å; K34-N186 PolarHBondContact O-ND2 3.07Å; D35-N186 VanDerWaalsContact OD1-CA 3.24Å; D35-N186 WeakPolarHBondContact OD1-CA 3.21Å; D35-N186 WeakPolarHBondContact OD1-CB 3.43Å; V41-N186 CarbonylContact C-O 3.58Å; V41-N186 WeakPolarHBondContact CA-O 3.49Å; H42-N186 PolarHBondContact N-O 3.45Å; H42-N186 PolarHBondContact ND1-O 3.48Å; H42-N186 PolarHBondContact O-N 2.88Å; T44-N186 HydrophobicContact CG2-CB 3.86Å; Q184-N186 WeakPolarHBondContact CG-OD1 3.21Å; Q184-N186 PolarHBondContact NE2-OD1 2.67Å
187	G	97.8	Very high	97.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	85.5	145.1	-179.1	0	0	0	0	0	113	D35 D36 K39 V41 K193	D35-G187 PolarHBondContact OD1-N 3.21Å; D36-G187 WeakPolarHBondContact O-CA 3.41Å; K39-G187 CarbonylContact O-C 3.54Å; K39-G187 VanDerWaalsContact O-C 3.28Å; K39-G187 WeakPolarHBondContact O-CA 3.38Å; V41-G187 WeakPolarHBondContact CG2-O 3.35Å; G187-K193 WeakPolarHBondContact O-CE 3.46Å; G187-K193 VanDerWaalsContact O-CG 3.25Å; G187-K193 WeakPolarHBondContact O-CG 3.17Å
188	G	97.5	Very high	97.7	Very high	5 Å²	5	27 Å²	27	5%	0.052	14%	0.138	C	C	.	.	S	Bend	trans	71.1	-179.6	-176	0	0	0	0	0	114.9	P37 K39 E192 K193	P37-G188 WeakPolarHBondContact O-CA 3.36Å; P37-G188 PolarHBondContact O-N 2.95Å; K39-G188 PolarHBondContact O-N 3.28Å; G188-E192 WeakPolarHBondContact CA-OE2 3.44Å; G188-K193 WeakPolarHBondContact O-CE 3.44Å; G188-K193 PolarHBondContact O-NZ 2.89Å
189	T	97.5	Very high	97.7	Very high	69 Å²	69	33.1 Å²	33.1	42%	0.423	17%	0.166	S	C	.	.			trans	-71.6	166.5	173.7	65.9	0	0	0	0	111.7	A191 E192 K193	T189-A191 VanDerWaalsContact C-N 3.26Å; T189-A191 PolarHBondContact O-N 2.84Å; T189-E192 WeakPolarHBondContact CG2-OE1 3.39Å; T189-E192 PolarHBondContact N-OE2 3.43Å; T189-E192 PolarHBondContact O-N 3.34Å; T189-E192 WeakPolarHBondContact OG1-CG 3.23Å; T189-E192 PolarHBondContact OG1-N 3.39Å; T189-E192 PolarHBondContact OG1-OE1 3.31Å; T189-K193 VanDerWaalsContact O-CG 3.3Å; T189-K193 WeakPolarHBondContact O-CG 3.24Å; T189-K193 PolarHBondContact O-N 2.89Å
190	V	97.2	Very high	97.6	Very high	34 Å²	34	35.1 Å²	35.1	21%	0.206	17%	0.174	C	C	.	.	H	α-helix	trans	-61.2	-37.5	176.5	173.9	0	0	0	0	111.5	C157 I160 K193 L194	C157-V190 WeakPolarHBondContact O-CG1 3.46Å; I160-V190 HydrophobicContact CD1-CG1 4.19Å; I160-V190 HydrophobicContact CG1-CG1 4.05Å; V190-K193 PolarHBondContact O-N 2.83Å; V190-L194 PolarHBondContact O-N 3.17Å; V190-L194 VanDerWaalsContact O-N 3.08Å
191	A	97.2	Very high	97.6	Very high	35 Å²	35	34.8 Å²	34.8	29%	0.289	17%	0.172	S	C	.	.	H	α-helix	trans	-63.1	-50.5	177.2	0	0	0	0	0	111	K154 T189 K193 L194 D195	K154-A191 HydrophobicContact CD-CB 4Å; K154-A191 HydrophobicContact CG-CB 4.41Å; T189-A191 VanDerWaalsContact C-N 3.26Å; T189-A191 PolarHBondContact O-N 2.84Å; A191-K193 VanDerWaalsContact C-N 3.33Å; A191-K193 PolarHBondContact O-N 3.04Å; A191-L194 WeakPolarHBondContact O-CB 3.27Å; A191-L194 PolarHBondContact O-N 3.48Å; A191-D195 PolarHBondContact O-N 2.61Å
192	E	97.7	Very high	97.5	Very high	94 Å²	94	38 Å²	38	44%	0.439	19%	0.187	S	C	.	.	H	α-helix	trans	-57.6	-43.5	176.1	-73.1	154.4	-137.5	0	0	112.2	V41 G188 T189 L194 D195 W196	V41-E192 HydrophobicContact CG2-CB 4.04Å; G188-E192 WeakPolarHBondContact CA-OE2 3.44Å; T189-E192 WeakPolarHBondContact CG2-OE1 3.39Å; T189-E192 PolarHBondContact N-OE2 3.43Å; T189-E192 PolarHBondContact O-N 3.34Å; T189-E192 WeakPolarHBondContact OG1-CG 3.23Å; T189-E192 PolarHBondContact OG1-N 3.39Å; T189-E192 PolarHBondContact OG1-OE1 3.31Å; E192-L194 VanDerWaalsContact C-N 3.26Å; E192-L194 PolarHBondContact O-N 3.02Å; E192-D195 PolarHBondContact O-N 2.84Å; E192-W196 WeakPolarHBondContact O-CB 3.13Å; E192-W196 PolarHBondContact O-N 3.02Å
193	K	98.4	Very high	97.5	Very high	6 Å²	6	39.8 Å²	39.8	3%	0.026	20%	0.195	C	C	.	.	H	α-helix	trans	-58.9	-40	175.6	-71.3	167	-170.1	149.7	0	112.1	D35 V41 I160 V185 G187 G188 T189 V190 A191 A197	D35-K193 IonicContact OD1-NZ 2.9Å; D35-K193 PolarHBondContact OD1-NZ 2.67Å; D35-K193 WeakPolarHBondContact OD2-CE 3.32Å; D35-K193 IonicContact OD2-NZ 2.88Å; D35-K193 PolarHBondContact OD2-NZ 2.55Å; V41-K193 HydrophobicContact CG1-CG 4.27Å; I160-K193 HydrophobicContact CB-CB 4.1Å; I160-K193 HydrophobicContact CG1-CB 4.15Å; V185-K193 HydrophobicContact CB-CB 4.4Å; V185-K193 HydrophobicContact CB-CG 4.44Å; V185-K193 HydrophobicContact CG1-CB 4.04Å; V185-K193 HydrophobicContact CG1-CG 3.95Å; G187-K193 WeakPolarHBondContact O-CE 3.46Å; G187-K193 VanDerWaalsContact O-CG 3.25Å; G187-K193 WeakPolarHBondContact O-CG 3.17Å; G188-K193 WeakPolarHBondContact O-CE 3.44Å; G188-K193 PolarHBondContact O-NZ 2.89Å; T189-K193 VanDerWaalsContact O-CG 3.3Å; T189-K193 WeakPolarHBondContact O-CG 3.24Å; T189-K193 PolarHBondContact O-N 2.89Å; V190-K193 PolarHBondContact O-N 2.83Å; A191-K193 VanDerWaalsContact C-N 3.33Å; A191-K193 PolarHBondContact O-N 3.04Å; K193-A197 WeakPolarHBondContact O-CB 3.45Å; K193-A197 PolarHBondContact O-N 3.04Å; K193-A197 VanDerWaalsContact O-N 3.08Å
194	L	97.6	Very high	97.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-72.9	-43	-178.5	-173.6	59	0	0	0	111.7	I89 F150 M153 K154 I160 V190 A191 E192 A197 R198	I89-L194 HydrophobicContact CD1-CD1 4.33Å; I89-L194 HydrophobicContact CG2-CD1 3.79Å; F150-L194 HydrophobicContact CB-CD2 4.34Å; F150-L194 HydrophobicContact CD1-CD1 3.96Å; F150-L194 HydrophobicContact CD1-CD2 3.95Å; F150-L194 HydrophobicContact CD1-CG 4Å; F150-L194 HydrophobicContact CE1-CD1 4.21Å; F150-L194 WeakPolarHBondContact O-CD2 3.39Å; M153-L194 HydrophobicContact CB-CD2 3.78Å; M153-L194 HydrophobicContact CE-CD1 3.63Å; K154-L194 HydrophobicContact CD-CD2 4.42Å; K154-L194 HydrophobicContact CG-CD2 3.46Å; K154-L194 VanDerWaalsContact CG-CD2 3.46Å; I160-L194 HydrophobicContact CD1-CD1 4.44Å; I160-L194 HydrophobicContact CG2-CD1 4.44Å; V190-L194 PolarHBondContact O-N 3.17Å; V190-L194 VanDerWaalsContact O-N 3.08Å; A191-L194 WeakPolarHBondContact O-CB 3.27Å; A191-L194 PolarHBondContact O-N 3.48Å; E192-L194 VanDerWaalsContact C-N 3.26Å; E192-L194 PolarHBondContact O-N 3.02Å; L194-A197 PolarHBondContact O-N 2.87Å; L194-R198 WeakPolarHBondContact O-CB 3.33Å; L194-R198 PolarHBondContact O-N 3.1Å
195	D	97.4	Very high	97.4	Very high	57 Å²	57	43.8 Å²	43.8	31%	0.305	21%	0.214	S	C	.	.	H	α-helix	trans	-65.5	-47.2	178.7	-66.6	-30.5	0	0	0	110.4	K154 A191 E192 A197 R198 E199	K154-D195 WeakPolarHBondContact CE-OD1 3.38Å; K154-D195 IonicContact NZ-OD1 2.59Å; K154-D195 PolarHBondContact NZ-OD1 3.02Å; K154-D195 IonicContact NZ-OD2 3.78Å; K154-D195 PolarHBondContact NZ-OD2 2.88Å; A191-D195 PolarHBondContact O-N 2.61Å; E192-D195 PolarHBondContact O-N 2.84Å; D195-A197 PolarHBondContact O-N 2.77Å; D195-R198 WeakPolarHBondContact O-CB 3.08Å; D195-R198 PolarHBondContact O-N 2.85Å; D195-E199 WeakPolarHBondContact O-CG 3.32Å; D195-E199 PolarHBondContact O-N 3.14Å
196	W	97.8	Very high	97.4	Very high	39 Å²	39	45 Å²	45	15%	0.148	22%	0.222	C	C	.	.	H	α-helix	trans	-56.2	-38.7	172.5	-177.4	102.8	0	0	0	112.8	V41 L43 V185 E192 R200	V41-W196 HydrophobicContact CB-CB 4.3Å; V41-W196 HydrophobicContact CB-CD2 4.37Å; V41-W196 HydrophobicContact CB-CG 3.89Å; V41-W196 HydrophobicContact CG1-CB 3.74Å; V41-W196 HydrophobicContact CG1-CD2 3.59Å; V41-W196 HydrophobicContact CG1-CE3 4.13Å; V41-W196 HydrophobicContact CG1-CG 3.4Å; V41-W196 PolarHBondContact O-NE1 3.32Å; L43-W196 HydrophobicContact CD1-CH2 4.14Å; L43-W196 HydrophobicContact CD2-CH2 3.72Å; L43-W196 HydrophobicContact CD2-CZ3 3.7Å; L43-W196 HydrophobicContact CG-CH2 3.57Å; L43-W196 HydrophobicContact CG-CZ3 4.1Å; V185-W196 HydrophobicContact CG1-CE3 4.03Å; V185-W196 HydrophobicContact CG1-CZ3 4.39Å; V185-W196 HydrophobicContact CG2-CE3 4.49Å; V185-W196 HydrophobicContact CG2-CZ3 4.38Å; E192-W196 WeakPolarHBondContact O-CB 3.13Å; E192-W196 PolarHBondContact O-N 3.02Å; W196-R200 VanDerWaalsContact CE2-NE 3.29Å; W196-R200 VanDerWaalsContact CG-NH1 3.35Å; W196-R200 VanDerWaalsContact CZ3-CD 3.41Å; W196-R200 PolarHBondContact O-N 3.16Å; W196-R200 PolarHBondContact O-NH1 3.35Å
197	A	97.8	Very high	97.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-73.1	-35.3	178.4	0	0	0	0	0	112.2	I89 I160 V162 K193 L194 D195 R200 L201	I89-A197 HydrophobicContact CD1-CB 3.76Å; I89-A197 HydrophobicContact CG1-CB 3.99Å; I89-A197 HydrophobicContact CG2-CB 4.18Å; I160-A197 HydrophobicContact CG2-CB 4.47Å; V162-A197 HydrophobicContact CG1-CB 3.62Å; K193-A197 WeakPolarHBondContact O-CB 3.45Å; K193-A197 PolarHBondContact O-N 3.04Å; K193-A197 VanDerWaalsContact O-N 3.08Å; L194-A197 PolarHBondContact O-N 2.87Å; D195-A197 PolarHBondContact O-N 2.77Å; A197-R200 PolarHBondContact O-N 2.79Å; A197-L201 PolarHBondContact O-N 2.63Å
198	R	96.4	Very high	97.3	Very high	87 Å²	87	49.1 Å²	49.1	33%	0.328	24%	0.244	S	C	.	.	H	α-helix	trans	-66.1	-46.7	176.6	-179.6	-179.8	174.7	159.4	4.3	110.8	I89 E147 F150 L194 D195 R200 L201	I89-R198 HydrophobicContact CD1-CB 4.31Å; E147-R198 VanDerWaalsContact CD-NH1 3.35Å; E147-R198 IonicContact OE1-CZ 3.21Å; E147-R198 IonicContact OE1-NH1 3.51Å; E147-R198 PolarHBondContact OE1-NH1 2.72Å; E147-R198 IonicContact OE1-NH2 2.66Å; E147-R198 PolarHBondContact OE1-NH2 2.9Å; E147-R198 IonicContact OE2-CZ 4Å; E147-R198 IonicContact OE2-NH1 2.61Å; E147-R198 PolarHBondContact OE2-NH1 2.88Å; F150-R198 HydrophobicContact CE1-CB 4.35Å; F150-R198 HydrophobicContact CE1-CG 4.34Å; F150-R198 HydrophobicContact CZ-CG 4.08Å; L194-R198 WeakPolarHBondContact O-CB 3.33Å; L194-R198 PolarHBondContact O-N 3.1Å; D195-R198 WeakPolarHBondContact O-CB 3.08Å; D195-R198 PolarHBondContact O-N 2.85Å; R198-R200 PolarHBondContact O-N 2.85Å; R198-L201 WeakPolarHBondContact O-CB 3.15Å; R198-L201 WeakPolarHBondContact O-CG 3.04Å; R198-L201 PolarHBondContact O-N 2.92Å; R198-L201 VanDerWaalsContact O-N 3.13Å
199	E	96.9	Very high	97.3	Very high	127 Å²	127	54.5 Å²	54.5	59%	0.593	27%	0.268	S	S	*	.	H	α-helix	trans	-57.6	-32.8	176.6	-72.3	172	-179.2	0	0	112.7	D195 Q203	D195-E199 WeakPolarHBondContact O-CG 3.32Å; D195-E199 PolarHBondContact O-N 3.14Å; E199-Q203 VanDerWaalsContact O-CD 3.26Å; E199-Q203 PolarHBondContact O-NE2 2.73Å
200	R	96.3	Very high	97.3	Very high	56 Å²	56	51.5 Å²	51.5	21%	0.211	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-0.3	-178.3	-77	168.9	176.6	76.2	-2.1	114.5	V86 W196 A197 R198 E202 Q203	V86-R200 WeakPolarHBondContact CB-O 3.17Å; W196-R200 VanDerWaalsContact CE2-NE 3.29Å; W196-R200 VanDerWaalsContact CG-NH1 3.35Å; W196-R200 VanDerWaalsContact CZ3-CD 3.41Å; W196-R200 PolarHBondContact O-N 3.16Å; W196-R200 PolarHBondContact O-NH1 3.35Å; A197-R200 PolarHBondContact O-N 2.79Å; R198-R200 PolarHBondContact O-N 2.85Å; R200-E202 PolarHBondContact O-N 2.84Å; R200-Q203 WeakPolarHBondContact O-CB 3.31Å; R200-Q203 PolarHBondContact O-N 2.66Å; R200-Q203 VanDerWaalsContact O-N 3.13Å
201	L	96.5	Very high	97.4	Very high	22 Å²	22	50 Å²	50	12%	0.115	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	135.2	172.4	-72.8	173.6	0	0	0	109.7	V86 I89 A107 W137 A197 R198 Q203	V86-L201 HydrophobicContact CG1-CD2 4.26Å; I89-L201 HydrophobicContact CD1-CD1 4.19Å; I89-L201 HydrophobicContact CD1-CD2 4.16Å; I89-L201 HydrophobicContact CD1-CG 4.17Å; I89-L201 HydrophobicContact CG1-CD2 3.98Å; A107-L201 HydrophobicContact CB-CB 4.47Å; A107-L201 HydrophobicContact CB-CD2 4.25Å; W137-L201 HydrophobicContact CH2-CD1 4.15Å; W137-L201 HydrophobicContact CZ2-CD1 4.35Å; A197-L201 PolarHBondContact O-N 2.63Å; R198-L201 WeakPolarHBondContact O-CB 3.15Å; R198-L201 WeakPolarHBondContact O-CG 3.04Å; R198-L201 PolarHBondContact O-N 2.92Å; R198-L201 VanDerWaalsContact O-N 3.13Å; L201-Q203 PolarHBondContact O-N 3.46Å
202	E	96.4	Very high	97.4	Very high	75 Å²	75	49.9 Å²	49.9	35%	0.35	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	-6.3	-179.4	-49.9	-179.9	-171.9	0	0	115.4	V86 A107 E108 H109 R200	V86-E202 WeakPolarHBondContact O-CA 3.43Å; V86-E202 PolarHBondContact O-N 3.26Å; A107-E202 HydrophobicContact CB-CG 3.55Å; E108-E202 WeakPolarHBondContact CA-OE1 3.41Å; E108-E202 WeakPolarHBondContact CB-OE1 3.39Å; E108-E202 PolarHBondContact N-OE1 3.47Å; H109-E202 WeakPolarHBondContact CB-OE2 3.36Å; H109-E202 IonicContact CD2-OE2 3.25Å; H109-E202 PolarHBondContact CD2-OE2 2.86Å; H109-E202 VanDerWaalsContact CD2-OE2 3.25Å; H109-E202 IonicContact CG-OE2 3.72Å; H109-E202 PolarHBondContact N-OE1 3.15Å; R200-E202 PolarHBondContact O-N 2.84Å
203	Q	97.3	Very high	97.3	Very high	105 Å²	105	49.5 Å²	49.5	49%	0.491	24%	0.24	S	C	.	.			trans	-82.5	152.1	178.2	-59.3	-172.5	-0.5	0	0	112.2	V85 V86 E199 R200 L201	V85-Q203 WeakPolarHBondContact CA-O 3.33Å; V86-Q203 PolarHBondContact N-O 3.25Å; E199-Q203 VanDerWaalsContact O-CD 3.26Å; E199-Q203 PolarHBondContact O-NE2 2.73Å; R200-Q203 WeakPolarHBondContact O-CB 3.31Å; R200-Q203 PolarHBondContact O-N 2.66Å; R200-Q203 VanDerWaalsContact O-N 3.13Å; L201-Q203 PolarHBondContact O-N 3.46Å
204	Q	97.3	Very high	97.3	Very high	100 Å²	100	50.6 Å²	50.6	47%	0.467	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	127.5	173	-74.2	-174.2	51.6	0	0	110.2	P83 M84 V85 Q167 P206	P83-Q204 HydrophobicContact CB-CB 4.07Å; P83-Q204 HydrophobicContact CB-CG 4.44Å; M84-Q204 CarbonylContact O-C 3.5Å; M84-Q204 WeakPolarHBondContact O-CA 3.44Å; V85-Q204 HydrophobicContact CG2-CG 3.89Å; Q167-Q204 VanDerWaalsContact NE2-CD 3.28Å; Q204-P206 WeakPolarHBondContact O-CD 3.25Å
205	V	97.7	Very high	97.3	Very high	5 Å²	5	53 Å²	53	3%	0.03	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	109.2	172.9	-176.4	0	0	0	0	108.2	L43 F46 P83 M84 V86 Q209 V210	L43-V205 HydrophobicContact CD1-CG1 3.87Å; L43-V205 HydrophobicContact CD1-CG2 4.37Å; F46-V205 WeakPolarHBondContact CE2-O 3.3Å; F46-V205 WeakPolarHBondContact CZ-O 3.38Å; P83-V205 WeakPolarHBondContact CA-O 3.41Å; M84-V205 PolarHBondContact N-O 3.2Å; M84-V205 PolarHBondContact O-N 2.93Å; V86-V205 HydrophobicContact CG2-CG2 3.88Å; V205-Q209 HydrophobicContact CG1-CB 4.33Å; V205-V210 HydrophobicContact CG1-CG2 3.92Å
206	P	97.9	Very high	97.3	Very high	26 Å²	26	51.4 Å²	51.4	17%	0.169	25%	0.249	C	C	.	.			trans	-73.7	161.8	170.8	31	-35.6	0	0	0	111.6	Q204 N208 Q209	Q204-P206 WeakPolarHBondContact O-CD 3.25Å; P206-N208 VanDerWaalsContact C-N 3.32Å; P206-N208 VanDerWaalsContact CB-OD1 3.29Å; P206-N208 WeakPolarHBondContact CB-OD1 3.35Å; P206-N208 WeakPolarHBondContact CG-OD1 3.44Å; P206-N208 PolarHBondContact O-N 3.24Å; P206-Q209 HydrophobicContact CG-CG 3.89Å; P206-Q209 PolarHBondContact O-N 3.01Å
207	V	98.2	Very high	97.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-68.4	-30.7	-173.3	67.6	0	0	0	0	113.3	F46 T81 Q209 V210 F211 I287 D329 V331	F46-V207 HydrophobicContact CD1-CB 4.17Å; F46-V207 HydrophobicContact CD1-CG2 3.98Å; F46-V207 HydrophobicContact CE1-CB 4Å; F46-V207 HydrophobicContact CE1-CG2 4.31Å; F46-V207 HydrophobicContact CE2-CB 4.4Å; F46-V207 HydrophobicContact CG-CB 4.49Å; F46-V207 HydrophobicContact CG-CG2 4.16Å; F46-V207 HydrophobicContact CZ-CB 4.09Å; T81-V207 HydrophobicContact CG2-CB 4.46Å; T81-V207 HydrophobicContact CG2-CG2 4.16Å; T81-V207 WeakPolarHBondContact OG1-CG1 3.4Å; V207-Q209 PolarHBondContact O-N 3.45Å; V207-V210 PolarHBondContact O-N 3.36Å; V207-F211 HydrophobicContact CG2-CD2 3.89Å; V207-F211 PolarHBondContact O-N 2.76Å; V207-I287 HydrophobicContact CG1-CG2 3.8Å; V207-D329 HydrophobicContact CG1-CB 4.16Å; V207-V331 HydrophobicContact CG1-CG2 4.21Å; V207-V331 HydrophobicContact CG2-CG2 3.61Å
208	N	97.3	Very high	97.4	Very high	89 Å²	89	49.6 Å²	49.6	48%	0.476	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-67.3	-19.6	179.4	63.7	-13.3	0	0	0	113.3	P206 V210 I287	P206-N208 VanDerWaalsContact C-N 3.32Å; P206-N208 VanDerWaalsContact CB-OD1 3.29Å; P206-N208 WeakPolarHBondContact CB-OD1 3.35Å; P206-N208 WeakPolarHBondContact CG-OD1 3.44Å; P206-N208 PolarHBondContact O-N 3.24Å; N208-V210 VanDerWaalsContact C-N 3.3Å; N208-I287 HydrophobicContact CB-CG2 4.11Å
209	Q	96.8	Very high	97.5	Very high	119 Å²	119	45.5 Å²	45.5	56%	0.556	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-79.5	-13.3	171.6	-71.7	179.7	9.5	0	0	112.8	V205 P206 V207	V205-Q209 HydrophobicContact CG1-CB 4.33Å; P206-Q209 HydrophobicContact CG-CG 3.89Å; P206-Q209 PolarHBondContact O-N 3.01Å; V207-Q209 PolarHBondContact O-N 3.45Å
210	V	98.1	Very high	97.5	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.036	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-43.2	-177.7	-176.3	0	0	0	0	111.6	L43 F46 V205 V207 N208 K349	L43-V210 HydrophobicContact CB-CG1 4.1Å; L43-V210 HydrophobicContact CB-CG2 3.97Å; L43-V210 HydrophobicContact CD1-CG2 4.08Å; F46-V210 HydrophobicContact CD2-CB 4.44Å; F46-V210 HydrophobicContact CD2-CG2 3.89Å; F46-V210 HydrophobicContact CE2-CG2 4.45Å; V205-V210 HydrophobicContact CG1-CG2 3.92Å; V207-V210 PolarHBondContact O-N 3.36Å; N208-V210 VanDerWaalsContact C-N 3.3Å; V210-K349 WeakPolarHBondContact O-CE 3.33Å; V210-K349 PolarHBondContact O-NZ 2.91Å
211	F	98.3	Very high	97.6	Very high	3 Å²	3	36.8 Å²	36.8	1%	0.013	19%	0.188	C	C	.	.			trans	-117.6	143.3	-177.8	-62.9	-65.3	0	0	0	111.4	F46 V207 I217 I284 I287 L347 K349	F46-F211 HydrophobicContact CB-CD2 4.39Å; F46-F211 HydrophobicContact CB-CE2 3.62Å; F46-F211 HydrophobicContact CB-CZ 4.48Å; V207-F211 HydrophobicContact CG2-CD2 3.89Å; V207-F211 PolarHBondContact O-N 2.76Å; F211-I217 HydrophobicContact CD1-CG2 3.43Å; F211-I217 VanDerWaalsContact CD1-CG2 3.43Å; F211-I217 HydrophobicContact CE1-CB 4.3Å; F211-I217 HydrophobicContact CE1-CG2 3.58Å; F211-I217 HydrophobicContact CG-CG2 4.19Å; F211-I217 HydrophobicContact CZ-CG2 4.44Å; F211-I284 HydrophobicContact CB-CD1 3.68Å; F211-I284 HydrophobicContact CG-CD1 4.15Å; F211-I287 HydrophobicContact CB-CD1 4.11Å; F211-I287 WeakPolarHBondContact O-CD1 3.19Å; F211-L347 HydrophobicContact CE2-CB 3.59Å; F211-L347 HydrophobicContact CE2-CD1 4.31Å; F211-L347 HydrophobicContact CZ-CB 3.74Å; F211-K349 HydrophobicContact CD1-CG 4.05Å; F211-K349 HydrophobicContact CE1-CB 4.39Å; F211-K349 HydrophobicContact CE1-CG 3.66Å
212	G	96.8	Very high	97.7	Very high	32 Å²	32	35.7 Å²	35.7	33%	0.33	18%	0.183	S	C	.	.			trans	-88.4	159.4	171.2	0	0	0	0	0	112.6	E215	G212-E215 PolarHBondContact N-OE2 2.84Å; G212-E215 WeakPolarHBondContact O-CB 3.46Å
213	Q	96.8	Very high	97.8	Very high	86 Å²	86	33.6 Å²	33.6	40%	0.402	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	144.5	164	-176.2	57.5	41.6	0	0	109.8	E215 Y285 K286	Q213-E215 PolarHBondContact O-N 2.81Å; Q213-Y285 PolarHBondContact NE2-O 2.85Å; Q213-K286 VanDerWaalsContact OE1-CA 3.26Å
214	D	97.3	Very high	97.9	Very high	29 Å²	29	34.8 Å²	34.8	16%	0.155	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	0.7	179.2	-51.5	-26.4	0	0	0	116.9	K283 I284 K362 I363	D214-K283 VanDerWaalsContact O-CE 3.3Å; D214-K283 WeakPolarHBondContact O-CE 3.11Å; D214-K283 PolarHBondContact O-NZ 2.87Å; D214-I284 VanDerWaalsContact CA-O 3.27Å; D214-I284 WeakPolarHBondContact CA-O 3.41Å; D214-I284 PolarHBondContact N-O 2.8Å; D214-K362 VanDerWaalsContact OD2-CA 3.29Å; D214-K362 WeakPolarHBondContact OD2-CA 3Å; D214-I363 VanDerWaalsContact CG-N 3.3Å; D214-I363 VanDerWaalsContact OD1-CB 3.25Å; D214-I363 WeakPolarHBondContact OD1-CB 3.13Å; D214-I363 PolarHBondContact OD1-N 3.35Å; D214-I363 PolarHBondContact OD2-N 3.1Å
215	E	97.1	Very high	97.9	Very high	49 Å²	49	31.8 Å²	31.8	23%	0.229	17%	0.174	C	C	.	.			trans	-67.4	145.7	178.9	-171.2	-179.9	169.7	0	0	111.6	G212 Q213 I217 I284 K349	G212-E215 PolarHBondContact N-OE2 2.84Å; G212-E215 WeakPolarHBondContact O-CB 3.46Å; Q213-E215 PolarHBondContact O-N 2.81Å; E215-I217 HydrophobicContact CG-CG2 4.37Å; E215-I284 PolarHBondContact O-N 2.83Å; E215-K349 IonicContact OE1-NZ 3.17Å; E215-K349 PolarHBondContact OE1-NZ 2.98Å; E215-K349 IonicContact OE2-NZ 2.89Å; E215-K349 PolarHBondContact OE2-NZ 2.67Å; E215-K349 VanDerWaalsContact OE2-NZ 3.09Å
216	M	98.2	Very high	98	Very high	25 Å²	25	36.9 Å²	36.9	12%	0.123	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	123.9	168.7	-67.1	-74.5	-107.7	0	0	110.2	N281 K283 S350 Q354 A359	M216-N281 HydrophobicContact CE-CB 3.65Å; M216-N281 WeakPolarHBondContact CE-O 3.29Å; M216-K283 VanDerWaalsContact SD-CA 3.6Å; M216-K283 HydrophobicContact SD-CB 3.53Å; M216-K283 VanDerWaalsContact SD-CB 3.53Å; M216-K283 HydrophobicContact SD-CD 4.3Å; M216-K283 HydrophobicContact SD-CG 4.05Å; M216-S350 WeakPolarHBondContact O-CB 3.36Å; M216-Q354 HydrophobicContact CB-CG 3.92Å; M216-Q354 HydrophobicContact CG-CG 4.29Å; M216-A359 HydrophobicContact CE-CB 4.12Å; M216-A359 HydrophobicContact CG-CB 3.83Å
217	I	98.3	Very high	98	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	165.9	178.9	67.3	160.7	0	0	0	112	F211 E215 V219 N281 K282 I284 L333 L347 R348	F211-I217 HydrophobicContact CD1-CG2 3.43Å; F211-I217 VanDerWaalsContact CD1-CG2 3.43Å; F211-I217 HydrophobicContact CE1-CB 4.3Å; F211-I217 HydrophobicContact CE1-CG2 3.58Å; F211-I217 HydrophobicContact CG-CG2 4.19Å; F211-I217 HydrophobicContact CZ-CG2 4.44Å; E215-I217 HydrophobicContact CG-CG2 4.37Å; I217-V219 HydrophobicContact CD1-CG2 4.34Å; I217-N281 PolarHBondContact O-N 2.74Å; I217-K282 HydrophobicContact CG1-CB 4.35Å; I217-K282 WeakPolarHBondContact CG1-O 3.17Å; I217-K282 PolarHBondContact N-O 3.03Å; I217-K282 PolarHBondContact O-N 2.86Å; I217-I284 HydrophobicContact CD1-CD1 4.3Å; I217-I284 HydrophobicContact CD1-CG1 4.27Å; I217-I284 HydrophobicContact CG1-CD1 4.45Å; I217-I284 HydrophobicContact CG1-CG1 4.22Å; I217-I284 HydrophobicContact CG2-CD1 3.7Å; I217-I284 HydrophobicContact CG2-CG1 4.22Å; I217-L333 HydrophobicContact CD1-CD1 4.22Å; I217-L333 HydrophobicContact CD1-CD2 3.58Å; I217-L333 HydrophobicContact CG1-CD2 3.89Å; I217-L347 HydrophobicContact CD1-CB 4.02Å; I217-L347 HydrophobicContact CD1-CD1 4.22Å; I217-L347 HydrophobicContact CD1-CD2 3.87Å; I217-L347 HydrophobicContact CD1-CG 4.24Å; I217-R348 WeakPolarHBondContact CB-O 3.17Å
218	D	98.6	Very high	98	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	131.1	172.1	-60.4	-27.1	0	0	0	110	T278 E279 I280 N281 R348 L351	D218-T278 HydrophobicContact CB-CG2 4.07Å; D218-E279 WeakPolarHBondContact CA-O 3.39Å; D218-I280 WeakPolarHBondContact OD1-CA 3.25Å; D218-I280 VanDerWaalsContact OD1-CB 3.31Å; D218-I280 WeakPolarHBondContact OD1-CB 3.35Å; D218-N281 PolarHBondContact OD1-N 3.05Å; D218-R348 HydrophobicContact CB-CB 4.41Å; D218-R348 PolarHBondContact N-O 3Å; D218-R348 PolarHBondContact O-N 3.49Å; D218-R348 IonicContact OD2-CZ 2.76Å; D218-R348 IonicContact OD2-NE 2.99Å; D218-R348 PolarHBondContact OD2-NE 3.27Å; D218-R348 IonicContact OD2-NH2 3.09Å; D218-R348 PolarHBondContact OD2-NH2 2.88Å; D218-L351 PolarHBondContact OD2-N 2.92Å
219	V	98.7	Very high	98	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	113.3	178.7	-173.8	0	0	0	0	109.6	I217 E279 K282 L333 V337 V338 L345 L347	I217-V219 HydrophobicContact CD1-CG2 4.34Å; V219-E279 PolarHBondContact N-O 3.37Å; V219-E279 PolarHBondContact O-N 3.4Å; V219-K282 HydrophobicContact CG2-CB 4.03Å; V219-K282 HydrophobicContact CG2-CG 3.82Å; V219-L333 HydrophobicContact CG2-CD1 3.68Å; V219-V337 HydrophobicContact CG1-CB 4.06Å; V219-V337 HydrophobicContact CG1-CG1 4.34Å; V219-V337 HydrophobicContact CG2-CG1 4.14Å; V219-V338 HydrophobicContact CG1-CG1 4.17Å; V219-L345 HydrophobicContact CG1-CB 4.18Å; V219-L345 HydrophobicContact CG1-CD1 4Å; V219-L345 HydrophobicContact CG1-CG 4.46Å; V219-L347 HydrophobicContact CG1-CD2 4.14Å; V219-L347 HydrophobicContact CG2-CD2 3.96Å
220	I	98.7	Very high	98.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127	-178.7	-47.6	177.7	0	0	0	109.2	V29 H276 R277 T278 T346 R348	V29-I220 HydrophobicContact CB-CD1 4.38Å; V29-I220 HydrophobicContact CG1-CD1 4.3Å; V29-I220 HydrophobicContact CG2-CD1 4.15Å; I220-H276 WeakPolarHBondContact CG2-NE2 3.41Å; I220-R277 WeakPolarHBondContact CA-O 3.45Å; I220-T278 HydrophobicContact CG1-CG2 3.87Å; I220-T346 PolarHBondContact N-O 2.9Å; I220-T346 PolarHBondContact O-N 3.34Å; I220-R348 HydrophobicContact CD1-CB 4.26Å
221	G	98.4	Very high	98.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	-172.6	-179.7	0	0	0	0	0	113.6	H276 R277	G221-H276 WeakPolarHBondContact O-CA 3.27Å; G221-R277 PolarHBondContact N-O 2.76Å; G221-R277 PolarHBondContact O-N 3.17Å
222	V	98.4	Very high	98	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.2	173.5	178	0	0	0	0	108.5	R24 H25 Y274 H275 V338 G339 R343	R24-V222 WeakPolarHBondContact O-CG2 3.39Å; H25-V222 WeakPolarHBondContact O-CG2 3.36Å; V222-Y274 VanDerWaalsContact CG1-C 3.5Å; V222-Y274 HydrophobicContact CG1-CD1 4.14Å; V222-Y274 HydrophobicContact CG1-CD2 3.64Å; V222-Y274 HydrophobicContact CG1-CE1 4.39Å; V222-Y274 HydrophobicContact CG1-CE2 3.9Å; V222-Y274 HydrophobicContact CG1-CG 3.77Å; V222-H275 CarbonylContact C-O 3.51Å; V222-H275 WeakPolarHBondContact CA-O 3.27Å; V222-V338 WeakPolarHBondContact O-CG2 3.31Å; V222-G339 VanDerWaalsContact O-CA 3.32Å; V222-G339 WeakPolarHBondContact O-CA 3.38Å; V222-R343 WeakPolarHBondContact O-CD 3.49Å; V222-R343 PolarHBondContact O-NH1 2.67Å
223	T	98.6	Very high	98.1	Very high	30 Å²	30	42.5 Å²	42.5	18%	0.184	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-69.5	157.6	-177.2	54.1	0	0	0	0	113	G225 Y274 H275 R277 V338 R343	T223-G225 PolarHBondContact O-N 2.96Å; T223-Y274 WeakPolarHBondContact O-CA 3.47Å; T223-Y274 PolarHBondContact O-N 2.68Å; T223-Y274 PolarHBondContact OG1-N 3.25Å; T223-Y274 VanDerWaalsContact OG1-N 3.16Å; T223-H275 PolarHBondContact N-O 2.89Å; T223-H275 PolarHBondContact OG1-N 2.7Å; T223-H275 PolarHBondContact OG1-O 2.84Å; T223-R277 HydrophobicContact CG2-CB 4.22Å; T223-R277 HydrophobicContact CG2-CG 3.62Å; T223-V338 HydrophobicContact CG2-CG2 4.27Å; T223-R343 PolarHBondContact O-NH1 2.8Å
224	K	98.3	Very high	98.1	Very high	131 Å²	131	40 Å²	40	57%	0.57	21%	0.212	S	C	*	.	P	Polyproline II helix	trans	-53.4	125.1	174	-179.1	172.2	-174.5	178.2	0	110	G273 Y274 T340	K224-G273 WeakPolarHBondContact O-CA 3.46Å; K224-Y274 PolarHBondContact O-N 2.81Å; K224-T340 HydrophobicContact CB-CG2 3.81Å; K224-T340 HydrophobicContact CD-CG2 3.79Å; K224-T340 HydrophobicContact CG-CG2 3.52Å
225	G	98.1	Very high	98.1	Very high	36 Å²	36	39 Å²	39	37%	0.371	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-70.7	137.3	176.4	0	0	0	0	0	110.6	T223	T223-G225 PolarHBondContact O-N 2.96Å
226	K	98.4	Very high	98.1	Very high	112 Å²	112	43.1 Å²	43.1	49%	0.487	22%	0.224	S	C	.	.			trans	-125.1	9.5	176.1	-56.9	-175.7	179.1	-174	0	112.3	K229 K272	K226-K229 HydrophobicContact CB-CG 4.48Å; K226-K229 WeakPolarHBondContact O-CE 3.43Å; K226-K272 WeakPolarHBondContact CA-O 3.21Å; K226-K272 HydrophobicContact CB-CB 4.27Å; K226-K272 HydrophobicContact CB-CD 4.49Å; K226-K272 HydrophobicContact CB-CG 4.3Å; K226-K272 WeakPolarHBondContact CB-O 3.41Å; K226-K272 HydrophobicContact CD-CD 3.98Å; K226-K272 HydrophobicContact CD-CG 4.23Å; K226-K272 PolarHBondContact N-O 2.81Å
227	G	98.1	Very high	98.1	Very high	34 Å²	34	42.6 Å²	42.6	35%	0.351	22%	0.223	S	C	.	.			trans	67.6	-156.6	179.8	0	0	0	0	0	114.1	K272	G227-K272 PolarHBondContact O-N 2.83Å
228	Y	98.5	Very high	98	Very high	174 Å²	174	51 Å²	51	68%	0.682	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	128.4	172.9	-165.1	-78.4	0	0	0	110	A269	Y228-A269 HydrophobicContact CE1-CB 3.81Å
229	K	98.4	Very high	97.9	Very high	89 Å²	89	56.4 Å²	56.4	39%	0.387	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	144.1	178.9	-68	-66.5	174.2	-171.4	0	111.4	K226 A269 G270 K272	K226-K229 HydrophobicContact CB-CG 4.48Å; K226-K229 WeakPolarHBondContact O-CE 3.43Å; K229-A269 WeakPolarHBondContact O-CA 3.49Å; K229-G270 PolarHBondContact N-O 2.89Å; K229-G270 PolarHBondContact O-N 3.39Å; K229-K272 HydrophobicContact CB-CB 3.86Å; K229-K272 HydrophobicContact CB-CD 4.23Å; K229-K272 HydrophobicContact CG-CB 3.77Å; K229-K272 HydrophobicContact CG-CD 4.03Å; K229-K272 HydrophobicContact CG-CG 4.48Å
230	G	97.8	Very high	97.9	Very high	36 Å²	36	58.2 Å²	58.2	37%	0.371	29%	0.292	S	S	.	.			trans	-64.7	163.9	173.3	0	0	0	0	0	113.4	T232 S233 R234	G230-T232 VanDerWaalsContact C-N 3.33Å; G230-T232 PolarHBondContact O-N 2.9Å; G230-S233 PolarHBondContact O-N 2.76Å; G230-R234 WeakPolarHBondContact O-CB 3.3Å; G230-R234 PolarHBondContact O-N 3.27Å
231	V	97.9	Very high	97.8	Very high	11 Å²	11	62.7 Å²	62.7	7%	0.067	32%	0.321	C	S	.	.	H	α-helix	trans	-54.6	-42.4	-174.5	-68	0	0	0	0	113.6	S233 R234 W235 H236 R249 V251 A267 A269	V231-S233 VanDerWaalsContact C-N 3.3Å; V231-S233 PolarHBondContact O-N 2.7Å; V231-R234 PolarHBondContact O-N 2.84Å; V231-W235 WeakPolarHBondContact O-CA 3.35Å; V231-W235 WeakPolarHBondContact O-CB 3.29Å; V231-W235 PolarHBondContact O-N 3.08Å; V231-H236 PolarHBondContact O-N 3.34Å; V231-R249 WeakPolarHBondContact CG2-O 3.21Å; V231-V251 HydrophobicContact CB-CG2 4.11Å; V231-V251 HydrophobicContact CG1-CG2 4.22Å; V231-V251 HydrophobicContact CG2-CG2 4.02Å; V231-A267 VanDerWaalsContact CG1-O 3.26Å; V231-A267 WeakPolarHBondContact CG1-O 3.35Å; V231-A269 HydrophobicContact CG1-CB 4.45Å; V231-A269 VanDerWaalsContact CG1-N 3.29Å
232	T	97.5	Very high	97.8	Very high	16 Å²	16	72.3 Å²	72.3	10%	0.098	36%	0.358	C	S	.	.	H	α-helix	trans	-58.7	-40.3	178.2	-51.7	0	0	0	0	111.9	G230 H236 T237 K239	G230-T232 VanDerWaalsContact C-N 3.33Å; G230-T232 PolarHBondContact O-N 2.9Å; T232-H236 WeakPolarHBondContact O-CA 3.15Å; T232-H236 PolarHBondContact O-N 3.42Å; T232-H236 VanDerWaalsContact O-N 3.17Å; T232-T237 WeakPolarHBondContact CA-OG1 3.43Å; T232-T237 WeakPolarHBondContact CG2-O 3.5Å; T232-T237 PolarHBondContact N-OG1 3.04Å; T232-K239 HydrophobicContact CG2-CG 3.85Å
233	S	97.4	Very high	97.7	Very high	34 Å²	34	80.9 Å²	80.9	24%	0.238	40%	0.395	C	S	.	.	H	α-helix	trans	-82.8	-41.6	177.4	-169.6	0	0	0	0	111.3	G230 V231 H236 K272	G230-S233 PolarHBondContact O-N 2.76Å; V231-S233 VanDerWaalsContact C-N 3.3Å; V231-S233 PolarHBondContact O-N 2.7Å; S233-H236 PolarHBondContact O-NE2 3Å; S233-K272 VanDerWaalsContact O-CE 3.31Å; S233-K272 WeakPolarHBondContact O-CE 3.33Å; S233-K272 PolarHBondContact O-NZ 2.96Å; S233-K272 PolarHBondContact OG-NZ 3.49Å
234	R	98	Very high	97.6	Very high	33 Å²	33	81.5 Å²	81.5	13%	0.125	40%	0.399	C	S	.	.	H	α-helix	trans	-72	-36.7	-173.1	-171.1	-178.8	-175.1	-150.6	5.2	113.5	R19 G230 V231 R268 A269 Q271 K272	R19-R234 PolarHBondContact NH1-O 3Å; R19-R234 PolarHBondContact O-NH2 2.88Å; G230-R234 WeakPolarHBondContact O-CB 3.3Å; G230-R234 PolarHBondContact O-N 3.27Å; V231-R234 PolarHBondContact O-N 2.84Å; R234-R268 WeakPolarHBondContact CD-O 3.2Å; R234-R268 PolarHBondContact NH1-O 2.99Å; R234-A269 VanDerWaalsContact NH1-C 3.32Å; R234-A269 PolarHBondContact NH1-O 3.06Å; R234-Q271 PolarHBondContact NE-O 2.78Å; R234-K272 HydrophobicContact CG-CB 4.45Å
235	W	97.9	Very high	97.4	Very high	8 Å²	8	82.1 Å²	82.1	3%	0.03	40%	0.403	C	S	.	.	H	α-helix	trans	-118.6	-7	-174	-67.9	100	0	0	0	113.7	L17 V231 T237 A267 R268	L17-W235 HydrophobicContact CD2-CH2 3.86Å; L17-W235 HydrophobicContact CD2-CZ2 4.16Å; L17-W235 HydrophobicContact CG-CH2 4.49Å; V231-W235 WeakPolarHBondContact O-CA 3.35Å; V231-W235 WeakPolarHBondContact O-CB 3.29Å; V231-W235 PolarHBondContact O-N 3.08Å; W235-T237 VanDerWaalsContact C-N 3.29Å; W235-T237 HydrophobicContact CB-CG2 4.02Å; W235-T237 PolarHBondContact O-N 3.37Å; W235-A267 HydrophobicContact CB-CB 3.81Å; W235-A267 HydrophobicContact CD2-CB 3.95Å; W235-A267 HydrophobicContact CG-CB 3.57Å; W235-R268 VanDerWaalsContact CD1-O 3.27Å; W235-R268 PolarHBondContact NE1-O 2.9Å
236	H	96.8	Very high	97.2	Very high	135 Å²	135	90.3 Å²	90.3	63%	0.625	42%	0.423	S	S	*	.			trans	60.9	36.7	-176.8	-46.9	124.1	0	0	0	112.9	H11 V231 T232 S233	H11-H236 PolarHBondContact CE1-O 3.46Å; H11-H236 PolarHBondContact ND1-O 3.02Å; H11-H236 VanDerWaalsContact ND1-O 3.14Å; V231-H236 PolarHBondContact O-N 3.34Å; T232-H236 WeakPolarHBondContact O-CA 3.15Å; T232-H236 PolarHBondContact O-N 3.42Å; T232-H236 VanDerWaalsContact O-N 3.17Å; S233-H236 PolarHBondContact O-NE2 3Å
237	T	96.6	Very high	97	Very high	14 Å²	14	87 Å²	87	9%	0.086	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-69.2	147.6	172.3	61	0	0	0	0	110.5	H11 T232 W235 V251 A267	H11-T237 HydrophobicContact CB-CG2 4.23Å; T232-T237 WeakPolarHBondContact CA-OG1 3.43Å; T232-T237 WeakPolarHBondContact CG2-O 3.5Å; T232-T237 PolarHBondContact N-OG1 3.04Å; W235-T237 VanDerWaalsContact C-N 3.29Å; W235-T237 HydrophobicContact CB-CG2 4.02Å; W235-T237 PolarHBondContact O-N 3.37Å; T237-V251 HydrophobicContact CG2-CG2 4.02Å; T237-A267 HydrophobicContact CG2-CB 3.89Å
238	K	96.6	Very high	97	Very high	178 Å²	178	88.4 Å²	88.4	77%	0.774	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-58.2	142.2	173.9	-166.3	176	177	175.7	0	110.3
239	K	97.4	Very high	96.9	Very high	114 Å²	114	86.7 Å²	86.7	50%	0.496	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-71.3	146.4	169.6	-65.6	176.4	-177.1	174.8	0	109.1	T232 L248	T232-K239 HydrophobicContact CG2-CG 3.85Å; K239-L248 HydrophobicContact CB-CD1 4.01Å; K239-L248 HydrophobicContact CD-CD1 3.82Å; K239-L248 HydrophobicContact CG-CD1 4.03Å
240	L	97.6	Very high	96.9	Very high	38 Å²	38	86 Å²	86	20%	0.199	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-74.6	163.3	172.6	-56.7	-179	0	0	0	111	T244 L248 K250 A252	L240-T244 HydrophobicContact CB-CG2 4.21Å; L240-T244 HydrophobicContact CD1-CG2 3.87Å; L240-L248 HydrophobicContact CB-CB 4.49Å; L240-L248 PolarHBondContact N-O 2.95Å; L240-K250 HydrophobicContact CD1-CD 4.22Å; L240-K250 HydrophobicContact CD1-CG 3.51Å; L240-K250 HydrophobicContact CG-CG 4.49Å; L240-A252 HydrophobicContact CD1-CB 4.22Å; L240-A252 HydrophobicContact CD2-CB 3.94Å
241	P	97.9	Very high	96.8	Very high	94 Å²	94	86.2 Å²	86.2	61%	0.61	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-54.5	152.8	177.5	-27.4	36.1	0	0	0	113.6	K243 T244	P241-K243 PolarHBondContact O-N 3.39Å; P241-T244 VanDerWaalsContact O-CB 3.3Å; P241-T244 WeakPolarHBondContact O-CB 3.46Å; P241-T244 PolarHBondContact O-N 2.84Å; P241-T244 PolarHBondContact O-OG1 3.34Å
242	R	97.4	Very high	96.8	Very high	202 Å²	202	89.4 Å²	89.4	76%	0.762	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-40.1	-178	-175	-176.7	64.1	78.1	-7.3	112.9	T244	R242-T244 PolarHBondContact O-N 3.27Å
243	K	96.9	Very high	96.7	Very high	179 Å²	179	92.6 Å²	92.6	78%	0.778	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	10.6	-178.4	-61.5	-173.8	178.2	-176.6	0	114	P241 H245	P241-K243 PolarHBondContact O-N 3.39Å; K243-H245 PolarHBondContact O-N 2.83Å
244	T	95.8	Very high	96.7	Very high	44 Å²	44	94.4 Å²	94.4	27%	0.27	46%	0.459	S	S	.	.			trans	-70.2	123.3	177.7	-64.2	0	0	0	0	111.8	L240 P241 R242	L240-T244 HydrophobicContact CB-CG2 4.21Å; L240-T244 HydrophobicContact CD1-CG2 3.87Å; P241-T244 VanDerWaalsContact O-CB 3.3Å; P241-T244 WeakPolarHBondContact O-CB 3.46Å; P241-T244 PolarHBondContact O-N 2.84Å; P241-T244 PolarHBondContact O-OG1 3.34Å; R242-T244 PolarHBondContact O-N 3.27Å
245	H	95.4	Very high	96.5	Very high	144 Å²	144	94.9 Å²	94.9	67%	0.667	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	142.9	173	-173.6	-130.2	0	0	0	112.1	K243 G247 K250	K243-H245 PolarHBondContact O-N 2.83Å; H245-G247 PolarHBondContact O-N 2.92Å; H245-K250 PolarHBondContact O-NZ 3Å
246	R	94	Very high	96.4	Very high	208 Å²	208	98.3 Å²	98.3	79%	0.785	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	40.6	-179.2	-58.4	174.8	-179.6	178.9	0.4	114.3	K250	R246-K250 PolarHBondContact O-NZ 2.99Å
247	G	94.1	Very high	96.3	Very high	42 Å²	42	102.3 Å²	102.3	43%	0.433	51%	0.514	S	S	.	.			trans	92.6	142.7	164.4	0	0	0	0	0	116.1	H245 K250	H245-G247 PolarHBondContact O-N 2.92Å; G247-K250 WeakPolarHBondContact O-CD 3.33Å; G247-K250 WeakPolarHBondContact O-CE 3.31Å
248	L	96.9	Very high	96.3	Very high	63 Å²	63	108.4 Å²	108.4	33%	0.33	54%	0.541	S	S	.	.	S	Bend	trans	-95.2	-12.9	-172.8	63.7	96	0	0	0	115	K239 L240 K250	K239-L248 HydrophobicContact CB-CD1 4.01Å; K239-L248 HydrophobicContact CD-CD1 3.82Å; K239-L248 HydrophobicContact CG-CD1 4.03Å; L240-L248 HydrophobicContact CB-CB 4.49Å; L240-L248 PolarHBondContact N-O 2.95Å; L248-K250 PolarHBondContact O-N 3.09Å
249	R	97.1	Very high	96.2	Very high	138 Å²	138	104.7 Å²	104.7	52%	0.521	54%	0.535	S	S	.	.	S	Bend	trans	-100	42.9	-173.1	-56.5	-173.3	72.5	110.3	2.9	112.8	V231	V231-R249 WeakPolarHBondContact CG2-O 3.21Å
250	K	97.2	Very high	96.2	Very high	74 Å²	74	103.7 Å²	103.7	32%	0.322	55%	0.548	S	S	.	.	S	Bend	trans	-125.5	167.1	-177.9	65.5	-171	179	-167.9	0	111.1	L240 H245 R246 G247 L248	L240-K250 HydrophobicContact CD1-CD 4.22Å; L240-K250 HydrophobicContact CD1-CG 3.51Å; L240-K250 HydrophobicContact CG-CG 4.49Å; H245-K250 PolarHBondContact O-NZ 3Å; R246-K250 PolarHBondContact O-NZ 2.99Å; G247-K250 WeakPolarHBondContact O-CD 3.33Å; G247-K250 WeakPolarHBondContact O-CE 3.31Å; L248-K250 PolarHBondContact O-N 3.09Å
251	V	97.2	Very high	96.1	Very high	41 Å²	41	111.4 Å²	111.4	25%	0.248	58%	0.575	C	S	.	*			trans	-87.9	128.7	163.7	178.9	0	0	0	0	106.2	V231 T237 C253 I254 A267	V231-V251 HydrophobicContact CB-CG2 4.11Å; V231-V251 HydrophobicContact CG1-CG2 4.22Å; V231-V251 HydrophobicContact CG2-CG2 4.02Å; T237-V251 HydrophobicContact CG2-CG2 4.02Å; V251-C253 VanDerWaalsContact CG1-O 3.23Å; V251-C253 WeakPolarHBondContact CG1-O 3.11Å; V251-I254 HydrophobicContact CB-CG2 4.49Å; V251-A267 HydrophobicContact CG2-CB 4.21Å; V251-A267 WeakPolarHBondContact CG2-O 3.01Å
252	A	96.5	Very high	96.1	Very high	79 Å²	79	109.9 Å²	109.9	65%	0.653	56%	0.564	S	S	*	*	S	Bend	trans	-66.5	-54.8	-175.9	0	0	0	0	0	112.2	L240	L240-A252 HydrophobicContact CD1-CB 4.22Å; L240-A252 HydrophobicContact CD2-CB 3.94Å
253	C	95.4	Very high	96.1	Very high	82 Å²	82	102.3 Å²	102.3	55%	0.554	54%	0.544	S	S	*	.			trans	-110.8	125.4	177.9	177.1	0	0	0	0	110.2	V251 G255	V251-C253 VanDerWaalsContact CG1-O 3.23Å; V251-C253 WeakPolarHBondContact CG1-O 3.11Å; C253-G255 PolarHBondContact SG-O 3.34Å
254	I	97.1	Very high	96.1	Very high	72 Å²	72	101.4 Å²	101.4	37%	0.369	54%	0.541	S	S	.	.			trans	-102.4	6.1	-178.1	63	173.1	0	0	0	113.7	V251 V262 V266	V251-I254 HydrophobicContact CB-CG2 4.49Å; I254-V262 HydrophobicContact CD1-CG2 3.75Å; I254-V262 HydrophobicContact CG1-CG2 4.2Å; I254-V266 HydrophobicContact CB-CG1 3.97Å; I254-V266 HydrophobicContact CG2-CG1 4.19Å; I254-V266 VanDerWaalsContact O-CG2 3.26Å; I254-V266 WeakPolarHBondContact O-CG2 3.34Å
255	G	95.1	Very high	96.2	Very high	43 Å²	43	100.9 Å²	100.9	44%	0.443	54%	0.539	S	S	.	.			trans	161.6	158.4	-179.3	0	0	0	0	0	111.2	C253	C253-G255 PolarHBondContact SG-O 3.34Å
256	A	95.4	Very high	96.3	Very high	81 Å²	81	95.3 Å²	95.3	67%	0.669	52%	0.515	S	S	*	.			trans	-74.6	174.9	166.6	0	0	0	0	0	110.4
257	W	95.3	Very high	96.4	Very high	218 Å²	218	86 Å²	86	83%	0.826	48%	0.482	S	S	*	.	S	Bend	trans	-60.9	-51.3	173.7	-170.2	-27.1	0	0	0	110.7	P259 A260	W257-P259 CarbonylContact O-C 3.26Å; W257-P259 VanDerWaalsContact O-C 3.26Å; W257-A260 WeakPolarHBondContact O-CA 3.25Å; W257-A260 PolarHBondContact O-N 2.8Å
258	H	95.2	Very high	96.6	Very high	143 Å²	143	90 Å²	90	66%	0.662	49%	0.485	S	S	*	.	S	Bend	trans	-110.7	125.9	175.3	-64.1	93.8	0	0	0	108.8
259	P	95.2	Very high	96.7	Very high	99 Å²	99	88.6 Å²	88.6	64%	0.643	48%	0.482	S	S	*	.	S	Bend	cis	-70.6	142.7	0.8	-17.6	32.3	0	0	0	113.8	W257 R261	W257-P259 CarbonylContact O-C 3.26Å; W257-P259 VanDerWaalsContact O-C 3.26Å; P259-R261 HydrophobicContact CB-CG 4.12Å; P259-R261 PolarHBondContact O-N 2.87Å
260	A	96.7	Very high	96.8	Very high	93 Å²	93	82.4 Å²	82.4	77%	0.769	46%	0.46	S	S	*	.	S	Bend	trans	-75.3	43.6	-178.7	0	0	0	0	0	113.7	W257	W257-A260 WeakPolarHBondContact O-CA 3.25Å; W257-A260 PolarHBondContact O-N 2.8Å
261	R	97.2	Very high	96.8	Very high	200 Å²	200	80.9 Å²	80.9	76%	0.755	46%	0.455	S	S	*	.	S	Bend	trans	-152	142.9	179.6	56.5	-173.8	-86.6	-169.8	-4.8	110.8	P259 A263	P259-R261 HydrophobicContact CB-CG 4.12Å; P259-R261 PolarHBondContact O-N 2.87Å; R261-A263 PolarHBondContact O-N 2.93Å
262	V	97.2	Very high	96.9	Very high	63 Å²	63	80.6 Å²	80.6	38%	0.382	45%	0.45	S	S	.	.			trans	-73.1	119.6	174.6	-177	0	0	0	0	109.5	I254 V266	I254-V262 HydrophobicContact CD1-CG2 3.75Å; I254-V262 HydrophobicContact CG1-CG2 4.2Å; V262-V266 HydrophobicContact CG1-CB 3.89Å; V262-V266 HydrophobicContact CG1-CG1 4.19Å; V262-V266 HydrophobicContact CG1-CG2 4.02Å
263	A	97.2	Very high	97	Very high	43 Å²	43	77.3 Å²	77.3	36%	0.355	42%	0.423	S	S	.	.			trans	-67.4	147.9	179.7	0	0	0	0	0	112.2	R261 S265 V266	R261-A263 PolarHBondContact O-N 2.93Å; A263-S265 PolarHBondContact O-N 2.81Å; A263-S265 VanDerWaalsContact O-N 3.11Å; A263-V266 HydrophobicContact CB-CG2 4.14Å; A263-V266 WeakPolarHBondContact O-CB 3.34Å; A263-V266 WeakPolarHBondContact O-CG2 2.99Å; A263-V266 PolarHBondContact O-N 3.42Å
264	F	97.2	Very high	97.1	Very high	160 Å²	160	75.5 Å²	75.5	70%	0.702	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-22	175.2	70.8	-91	0	0	0	112.8	L17 V266	L17-F264 HydrophobicContact CD1-CD2 3.8Å; L17-F264 HydrophobicContact CD1-CE2 4.3Å; F264-V266 VanDerWaalsContact C-N 3.27Å
265	S	97	Very high	97.2	Very high	32 Å²	32	72.8 Å²	72.8	22%	0.224	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.3	176.2	69.5	0	0	0	0	112	R10 A263 A267	R10-S265 PolarHBondContact NH1-O 2.97Å; R10-S265 PolarHBondContact NH2-O 2.95Å; A263-S265 PolarHBondContact O-N 2.81Å; A263-S265 VanDerWaalsContact O-N 3.11Å; S265-A267 PolarHBondContact O-N 2.99Å
266	V	97.3	Very high	97.3	Very high	28 Å²	28	72.5 Å²	72.5	17%	0.17	38%	0.378	C	S	.	.	S	Bend	trans	-72.4	132.1	178	178.6	0	0	0	0	109.5	I254 V262 A263 F264 R268	I254-V266 HydrophobicContact CB-CG1 3.97Å; I254-V266 HydrophobicContact CG2-CG1 4.19Å; I254-V266 VanDerWaalsContact O-CG2 3.26Å; I254-V266 WeakPolarHBondContact O-CG2 3.34Å; V262-V266 HydrophobicContact CG1-CB 3.89Å; V262-V266 HydrophobicContact CG1-CG1 4.19Å; V262-V266 HydrophobicContact CG1-CG2 4.02Å; A263-V266 HydrophobicContact CB-CG2 4.14Å; A263-V266 WeakPolarHBondContact O-CB 3.34Å; A263-V266 WeakPolarHBondContact O-CG2 2.99Å; A263-V266 PolarHBondContact O-N 3.42Å; F264-V266 VanDerWaalsContact C-N 3.27Å; V266-R268 PolarHBondContact O-N 3.16Å; V266-R268 VanDerWaalsContact O-N 3.11Å
267	A	97.9	Very high	97.5	Very high	12 Å²	12	71 Å²	71	10%	0.099	36%	0.355	C	S	.	.			trans	-66.8	112.3	178.2	0	0	0	0	0	110.2	V231 W235 T237 V251 S265	V231-A267 VanDerWaalsContact CG1-O 3.26Å; V231-A267 WeakPolarHBondContact CG1-O 3.35Å; W235-A267 HydrophobicContact CB-CB 3.81Å; W235-A267 HydrophobicContact CD2-CB 3.95Å; W235-A267 HydrophobicContact CG-CB 3.57Å; T237-A267 HydrophobicContact CG2-CB 3.89Å; V251-A267 HydrophobicContact CG2-CB 4.21Å; V251-A267 WeakPolarHBondContact CG2-O 3.01Å; S265-A267 PolarHBondContact O-N 2.99Å
268	R	98.3	Very high	97.6	Very high	127 Å²	127	63.2 Å²	63.2	48%	0.479	33%	0.332	S	S	.	.			trans	-118.3	154.7	177.3	-57.6	-62.7	-68.9	-83.3	2.1	112.3	R234 W235 V266	R234-R268 WeakPolarHBondContact CD-O 3.2Å; R234-R268 PolarHBondContact NH1-O 2.99Å; W235-R268 VanDerWaalsContact CD1-O 3.27Å; W235-R268 PolarHBondContact NE1-O 2.9Å; V266-R268 PolarHBondContact O-N 3.16Å; V266-R268 VanDerWaalsContact O-N 3.11Å
269	A	98.2	Very high	97.8	Very high	33 Å²	33	58.9 Å²	58.9	27%	0.273	31%	0.312	S	S	.	.			trans	-63.3	162.4	173.9	0	0	0	0	0	111.1	Y228 K229 V231 R234	Y228-A269 HydrophobicContact CE1-CB 3.81Å; K229-A269 WeakPolarHBondContact O-CA 3.49Å; V231-A269 HydrophobicContact CG1-CB 4.45Å; V231-A269 VanDerWaalsContact CG1-N 3.29Å; R234-A269 VanDerWaalsContact NH1-C 3.32Å; R234-A269 PolarHBondContact NH1-O 3.06Å
270	G	98.5	Very high	97.9	Very high	7 Å²	7	58.4 Å²	58.4	7%	0.072	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150.7	-161	179.1	0	0	0	0	0	113.1	K229 K272	K229-G270 PolarHBondContact N-O 2.89Å; K229-G270 PolarHBondContact O-N 3.39Å; G270-K272 PolarHBondContact O-N 3.28Å
271	Q	98.4	Very high	97.9	Very high	43 Å²	43	56.7 Å²	56.7	20%	0.201	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	128.8	-179.3	179.2	63.6	28.1	0	0	112.4	R21 R234 G273	R21-Q271 HydrophobicContact CG-CG 3.87Å; R234-Q271 PolarHBondContact NE-O 2.78Å; Q271-G273 PolarHBondContact NE2-O 3.15Å
272	K	98.4	Very high	97.9	Very high	35 Å²	35	48.8 Å²	48.8	15%	0.152	25%	0.252	C	S	.	.			trans	-117.7	124.2	168.1	-174.4	179	-177.6	173.6	0	110.1	K226 G227 K229 S233 R234 G270	K226-K272 WeakPolarHBondContact CA-O 3.21Å; K226-K272 HydrophobicContact CB-CB 4.27Å; K226-K272 HydrophobicContact CB-CD 4.49Å; K226-K272 HydrophobicContact CB-CG 4.3Å; K226-K272 WeakPolarHBondContact CB-O 3.41Å; K226-K272 HydrophobicContact CD-CD 3.98Å; K226-K272 HydrophobicContact CD-CG 4.23Å; K226-K272 PolarHBondContact N-O 2.81Å; G227-K272 PolarHBondContact O-N 2.83Å; K229-K272 HydrophobicContact CB-CB 3.86Å; K229-K272 HydrophobicContact CB-CD 4.23Å; K229-K272 HydrophobicContact CG-CB 3.77Å; K229-K272 HydrophobicContact CG-CD 4.03Å; K229-K272 HydrophobicContact CG-CG 4.48Å; S233-K272 VanDerWaalsContact O-CE 3.31Å; S233-K272 WeakPolarHBondContact O-CE 3.33Å; S233-K272 PolarHBondContact O-NZ 2.96Å; S233-K272 PolarHBondContact OG-NZ 3.49Å; R234-K272 HydrophobicContact CG-CB 4.45Å; G270-K272 PolarHBondContact O-N 3.28Å
273	G	98.1	Very high	98	Very high	9 Å²	9	46.1 Å²	46.1	9%	0.093	24%	0.235	C	C	.	.	S	Bend	trans	78.6	-179.2	177.7	0	0	0	0	0	112.6	K224 Q271 H275	K224-G273 WeakPolarHBondContact O-CA 3.46Å; Q271-G273 PolarHBondContact NE2-O 3.15Å; G273-H275 PolarHBondContact N-NE2 2.73Å; G273-H275 PolarHBondContact O-CD2 2.99Å; G273-H275 PolarHBondContact O-N 2.58Å; G273-H275 PolarHBondContact O-NE2 3.41Å
274	Y	98.5	Very high	98.1	Very high	45 Å²	45	44.1 Å²	44.1	18%	0.176	22%	0.218	C	C	.	.			trans	61	32	-165.2	-153.2	-101.6	0	0	0	112.6	R21 S22 H25 V222 T223 K224	R21-Y274 CarbonylContact C-O 3.57Å; R21-Y274 HydrophobicContact CB-CD1 3.85Å; R21-Y274 HydrophobicContact CG-CD1 4.08Å; S22-Y274 WeakPolarHBondContact CB-O 3.32Å; S22-Y274 PolarHBondContact N-O 3.45Å; S22-Y274 WeakPolarHBondContact O-CE1 3.3Å; H25-Y274 PolarHBondContact ND1-OH 2.96Å; H25-Y274 VanDerWaalsContact ND1-OH 3.15Å; V222-Y274 VanDerWaalsContact CG1-C 3.5Å; V222-Y274 HydrophobicContact CG1-CD1 4.14Å; V222-Y274 HydrophobicContact CG1-CD2 3.64Å; V222-Y274 HydrophobicContact CG1-CE1 4.39Å; V222-Y274 HydrophobicContact CG1-CE2 3.9Å; V222-Y274 HydrophobicContact CG1-CG 3.77Å; T223-Y274 WeakPolarHBondContact O-CA 3.47Å; T223-Y274 PolarHBondContact O-N 2.68Å; T223-Y274 PolarHBondContact OG1-N 3.25Å; T223-Y274 VanDerWaalsContact OG1-N 3.16Å; K224-Y274 PolarHBondContact O-N 2.81Å
275	H	98.5	Very high	98.1	Very high	14 Å²	14	36.6 Å²	36.6	7%	0.065	19%	0.185	C	C	.	.			trans	-98.8	147.6	175.9	-49.4	162.4	0	0	0	110.5	K20 V222 T223 G273 R277	K20-H275 PolarHBondContact O-CD2 3.45Å; V222-H275 CarbonylContact C-O 3.51Å; V222-H275 WeakPolarHBondContact CA-O 3.27Å; T223-H275 PolarHBondContact N-O 2.89Å; T223-H275 PolarHBondContact OG1-N 2.7Å; T223-H275 PolarHBondContact OG1-O 2.84Å; G273-H275 PolarHBondContact N-NE2 2.73Å; G273-H275 PolarHBondContact O-CD2 2.99Å; G273-H275 PolarHBondContact O-N 2.58Å; G273-H275 PolarHBondContact O-NE2 3.41Å; H275-R277 PolarHBondContact ND1-NH2 2.99Å
276	H	98.5	Very high	98.1	Very high	37 Å²	37	37.2 Å²	37.2	17%	0.171	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	130.2	169	177.7	-80.7	0	0	0	110.5	K28 I220 G221	K28-H276 PolarHBondContact N-NE2 3.1Å; K28-H276 PolarHBondContact O-NE2 3.36Å; I220-H276 WeakPolarHBondContact CG2-NE2 3.41Å; G221-H276 WeakPolarHBondContact O-CA 3.27Å
277	R	98.2	Very high	98.2	Very high	50 Å²	50	37.5 Å²	37.5	19%	0.189	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	149.7	176.4	-66.5	-64.2	179.9	-98.3	3.9	110.1	F16 I220 G221 T223 H275	F16-R277 VanDerWaalsContact CD1-CZ 3.46Å; I220-R277 WeakPolarHBondContact CA-O 3.45Å; G221-R277 PolarHBondContact N-O 2.76Å; G221-R277 PolarHBondContact O-N 3.17Å; T223-R277 HydrophobicContact CG2-CB 4.22Å; T223-R277 HydrophobicContact CG2-CG 3.62Å; H275-R277 PolarHBondContact ND1-NH2 2.99Å
278	T	98.4	Very high	98.1	Very high	55 Å²	55	37 Å²	37	34%	0.337	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.7	167.3	-59.9	0	0	0	0	107	D218 I220 I280	D218-T278 HydrophobicContact CB-CG2 4.07Å; I220-T278 HydrophobicContact CG1-CG2 3.87Å; T278-I280 HydrophobicContact CG2-CG2 3.92Å
279	E	98.1	Very high	98	Very high	51 Å²	51	36.6 Å²	36.6	24%	0.238	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	109.6	168.5	-68.4	-177.9	-153.2	0	0	107.7	D218 V219 K282 V338	D218-E279 WeakPolarHBondContact CA-O 3.39Å; V219-E279 PolarHBondContact N-O 3.37Å; V219-E279 PolarHBondContact O-N 3.4Å; E279-K282 WeakPolarHBondContact OE2-CE 3.16Å; E279-K282 IonicContact OE2-NZ 2.66Å; E279-K282 PolarHBondContact OE2-NZ 3.41Å; E279-V338 HydrophobicContact CG-CG1 3.98Å; E279-V338 WeakPolarHBondContact OE1-CA 3.43Å; E279-V338 WeakPolarHBondContact OE1-CB 3.01Å; E279-V338 PolarHBondContact OE1-N 2.91Å
280	I	97.4	Very high	97.8	Very high	89 Å²	89	35.4 Å²	35.4	46%	0.456	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	163.4	-179.1	63.2	174.4	0	0	0	111.7	D218 T278 K282 L352	D218-I280 WeakPolarHBondContact OD1-CA 3.25Å; D218-I280 VanDerWaalsContact OD1-CB 3.31Å; D218-I280 WeakPolarHBondContact OD1-CB 3.35Å; T278-I280 HydrophobicContact CG2-CG2 3.92Å; I280-K282 PolarHBondContact O-N 2.79Å; I280-L352 HydrophobicContact CD1-CD1 4.21Å
281	N	97.1	Very high	97.5	Very high	58 Å²	58	37.2 Å²	37.2	31%	0.31	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	59.3	43.4	168.3	-64.5	-13.4	0	0	0	114	M216 I217 D218 Q354	M216-N281 HydrophobicContact CE-CB 3.65Å; M216-N281 WeakPolarHBondContact CE-O 3.29Å; I217-N281 PolarHBondContact O-N 2.74Å; D218-N281 PolarHBondContact OD1-N 3.05Å; N281-Q354 PolarHBondContact OD1-NE2 2.86Å
282	K	98.3	Very high	97	Very high	34 Å²	34	39 Å²	39	15%	0.148	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	113.3	170.3	-62.7	-64.8	178.1	166.6	0	108.9	I217 V219 E279 I280 C336	I217-K282 HydrophobicContact CG1-CB 4.35Å; I217-K282 WeakPolarHBondContact CG1-O 3.17Å; I217-K282 PolarHBondContact N-O 3.03Å; I217-K282 PolarHBondContact O-N 2.86Å; V219-K282 HydrophobicContact CG2-CB 4.03Å; V219-K282 HydrophobicContact CG2-CG 3.82Å; E279-K282 WeakPolarHBondContact OE2-CE 3.16Å; E279-K282 IonicContact OE2-NZ 2.66Å; E279-K282 PolarHBondContact OE2-NZ 3.41Å; I280-K282 PolarHBondContact O-N 2.79Å; K282-C336 PolarHBondContact NZ-O 2.93Å
283	K	98.3	Very high	96.6	Very high	7 Å²	7	43.6 Å²	43.6	3%	0.03	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	133.7	178.1	-164.7	157.7	-178.9	126.1	0	110.7	D214 M216 Y285 K334 R358 A359 E361 I363	D214-K283 VanDerWaalsContact O-CE 3.3Å; D214-K283 WeakPolarHBondContact O-CE 3.11Å; D214-K283 PolarHBondContact O-NZ 2.87Å; M216-K283 VanDerWaalsContact SD-CA 3.6Å; M216-K283 HydrophobicContact SD-CB 3.53Å; M216-K283 VanDerWaalsContact SD-CB 3.53Å; M216-K283 HydrophobicContact SD-CD 4.3Å; M216-K283 HydrophobicContact SD-CG 4.05Å; K283-Y285 HydrophobicContact CB-CD1 4.19Å; K283-Y285 HydrophobicContact CB-CE1 3.87Å; K283-Y285 HydrophobicContact CD-CE1 4.01Å; K283-Y285 HydrophobicContact CG-CD1 4.01Å; K283-Y285 HydrophobicContact CG-CE1 3.86Å; K283-K334 HydrophobicContact CB-CB 4.19Å; K283-K334 PolarHBondContact O-N 2.92Å; K283-R358 PolarHBondContact NZ-O 2.67Å; K283-A359 PolarHBondContact NZ-O 3.11Å; K283-E361 WeakPolarHBondContact CE-O 3.35Å; K283-E361 PolarHBondContact NZ-O 2.83Å; K283-I363 HydrophobicContact CD-CD1 4.1Å; K283-I363 HydrophobicContact CD-CG1 4.13Å; K283-I363 VanDerWaalsContact CE-CG1 3.44Å
284	I	98.5	Very high	95.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	126.6	167.2	-63.8	176.1	0	0	0	108.1	F211 D214 E215 I217 I287 V331 L333	F211-I284 HydrophobicContact CB-CD1 3.68Å; F211-I284 HydrophobicContact CG-CD1 4.15Å; D214-I284 VanDerWaalsContact CA-O 3.27Å; D214-I284 WeakPolarHBondContact CA-O 3.41Å; D214-I284 PolarHBondContact N-O 2.8Å; E215-I284 PolarHBondContact O-N 2.83Å; I217-I284 HydrophobicContact CD1-CD1 4.3Å; I217-I284 HydrophobicContact CD1-CG1 4.27Å; I217-I284 HydrophobicContact CG1-CD1 4.45Å; I217-I284 HydrophobicContact CG1-CG1 4.22Å; I217-I284 HydrophobicContact CG2-CD1 3.7Å; I217-I284 HydrophobicContact CG2-CG1 4.22Å; I284-I287 HydrophobicContact CD1-CD1 4.49Å; I284-I287 HydrophobicContact CG2-CD1 4.36Å; I284-I287 HydrophobicContact CG2-CG1 3.65Å; I284-V331 HydrophobicContact CB-CG1 4.4Å; I284-V331 HydrophobicContact CD1-CG1 4.03Å; I284-V331 HydrophobicContact CG1-CG1 3.76Å; I284-V331 HydrophobicContact CG2-CG1 3.96Å; I284-L333 HydrophobicContact CG1-CD2 3.68Å
285	Y	98.2	Very high	95.3	Very high	2 Å²	2	54 Å²	54	1%	0.008	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-25.4	177.8	-80.4	11.7	0	0	0	112.7	I56 E74 V76 Q213 K283 M332 K334 I363 L365	I56-Y285 HydrophobicContact CD1-CD2 3.95Å; I56-Y285 HydrophobicContact CD1-CE2 3.93Å; I56-Y285 HydrophobicContact CG1-CD2 4.06Å; I56-Y285 HydrophobicContact CG1-CE2 4.33Å; E74-Y285 HydrophobicContact CB-CE2 4.36Å; E74-Y285 VanDerWaalsContact OE2-CE2 3.27Å; E74-Y285 WeakPolarHBondContact OE2-CE2 3.47Å; E74-Y285 VanDerWaalsContact OE2-CZ 3.24Å; E74-Y285 PolarHBondContact OE2-OH 3.08Å; V76-Y285 HydrophobicContact CG1-CD2 3.71Å; V76-Y285 HydrophobicContact CG1-CE2 4.22Å; Q213-Y285 PolarHBondContact NE2-O 2.85Å; K283-Y285 HydrophobicContact CB-CD1 4.19Å; K283-Y285 HydrophobicContact CB-CE1 3.87Å; K283-Y285 HydrophobicContact CD-CE1 4.01Å; K283-Y285 HydrophobicContact CG-CD1 4.01Å; K283-Y285 HydrophobicContact CG-CE1 3.86Å; Y285-M332 PolarHBondContact N-O 3.26Å; Y285-K334 HydrophobicContact CD1-CB 4.26Å; Y285-K334 HydrophobicContact CE1-CB 3.76Å; Y285-K334 HydrophobicContact CE1-CD 4.24Å; Y285-K334 HydrophobicContact CE1-CG 4.1Å; Y285-K334 HydrophobicContact CE2-CB 4.27Å; Y285-K334 HydrophobicContact CE2-CG 4.19Å; Y285-K334 WeakPolarHBondContact OH-CD 3.43Å; Y285-K334 WeakPolarHBondContact OH-CG 3.48Å; Y285-K334 PolarHBondContact OH-NZ 3.27Å; Y285-I363 HydrophobicContact CD1-CB 4.38Å; Y285-I363 HydrophobicContact CD1-CD1 4.21Å; Y285-I363 HydrophobicContact CD1-CG1 3.77Å; Y285-I363 HydrophobicContact CD1-CG2 4.01Å; Y285-I363 HydrophobicContact CD2-CG2 4.3Å; Y285-I363 HydrophobicContact CE1-CD1 3.78Å; Y285-I363 HydrophobicContact CE1-CG1 3.85Å; Y285-I363 HydrophobicContact CE1-CG2 4.41Å; Y285-I363 HydrophobicContact CG-CG2 3.94Å; Y285-L365 HydrophobicContact CD2-CD2 4.32Å
286	K	98	Very high	94.8	Very high	46 Å²	46	56.9 Å²	56.9	20%	0.2	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	132.2	173.3	-169.9	160.3	-178.3	160.6	0	108.7	Q213 N302 S304 M332 L365 I368	Q213-K286 VanDerWaalsContact OE1-CA 3.26Å; K286-N302 WeakPolarHBondContact CE-O 3.42Å; K286-N302 PolarHBondContact NZ-O 3.28Å; K286-S304 PolarHBondContact NZ-O 3.38Å; K286-M332 HydrophobicContact CB-CB 4.01Å; K286-M332 HydrophobicContact CB-SD 4.33Å; K286-M332 PolarHBondContact O-N 3.48Å; K286-L365 HydrophobicContact CB-CD1 4Å; K286-L365 HydrophobicContact CD-CD1 4.11Å; K286-I368 HydrophobicContact CD-CD1 4.2Å
287	I	98	Very high	94.3	Very high	33 Å²	33	62.8 Å²	62.8	17%	0.169	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	99.3	157.6	-56.6	-176.3	0	0	0	106	V207 N208 F211 I284 F330	V207-I287 HydrophobicContact CG1-CG2 3.8Å; N208-I287 HydrophobicContact CB-CG2 4.11Å; F211-I287 HydrophobicContact CB-CD1 4.11Å; F211-I287 WeakPolarHBondContact O-CD1 3.19Å; I284-I287 HydrophobicContact CD1-CD1 4.49Å; I284-I287 HydrophobicContact CG2-CD1 4.36Å; I284-I287 HydrophobicContact CG2-CG1 3.65Å; I287-F330 CarbonylContact C-O 3.55Å
288	G	96.2	Very high	93.8	Very high	3 Å²	3	64.8 Å²	64.8	3%	0.031	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	140.2	-177	0	0	0	0	0	111.3	D329 F330	G288-D329 CarbonylContact O-C 3.43Å; G288-D329 VanDerWaalsContact O-CA 3.27Å; G288-D329 WeakPolarHBondContact O-CA 3.34Å; G288-F330 PolarHBondContact N-O 2.85Å; G288-F330 PolarHBondContact O-N 3.16Å
289	Q	95.7	Very high	93.4	Very high	118 Å²	118	65.1 Å²	65.1	55%	0.551	34%	0.337	S	S	*	.			trans	-73.4	148.1	172.7	-67	178.8	-13.5	0	0	110.5	L292 N302 D329	Q289-L292 HydrophobicContact CB-CD1 4.12Å; Q289-N302 WeakPolarHBondContact O-CB 3.42Å; Q289-N302 PolarHBondContact O-ND2 3.3Å; Q289-D329 WeakPolarHBondContact CA-OD1 3.33Å
290	G	93.8	Very high	93.1	Very high	7 Å²	7	67 Å²	67	7%	0.072	34%	0.344	C	S	.	.			trans	-65.3	-175	169.1	0	0	0	0	0	112.6	L292 T327 N328 D329	G290-L292 PolarHBondContact O-N 2.72Å; G290-T327 CarbonylContact C-O 3.55Å; G290-T327 VanDerWaalsContact CA-O 3.29Å; G290-T327 WeakPolarHBondContact CA-O 3.38Å; G290-N328 WeakPolarHBondContact CA-O 3.32Å; G290-D329 PolarHBondContact N-OD1 2.85Å
291	Y	93.9	Very high	92.8	Very high	45 Å²	45	66 Å²	66	18%	0.176	34%	0.34	C	S	.	.			trans	-68.7	129	170.6	-64.5	-13	0	0	0	109.5	K300 S313 N315 T327	Y291-K300 HydrophobicContact CD1-CB 3.91Å; Y291-K300 HydrophobicContact CD1-CG 3.79Å; Y291-K300 HydrophobicContact CD2-CD 4.35Å; Y291-K300 HydrophobicContact CD2-CG 4.18Å; Y291-K300 HydrophobicContact CE1-CB 3.65Å; Y291-K300 HydrophobicContact CE1-CD 4.27Å; Y291-K300 HydrophobicContact CE1-CG 3.8Å; Y291-K300 HydrophobicContact CE2-CD 4Å; Y291-K300 HydrophobicContact CE2-CG 4.18Å; Y291-K300 HydrophobicContact CG-CG 3.99Å; Y291-S313 WeakPolarHBondContact OH-CB 3.49Å; Y291-S313 PolarHBondContact OH-OG 2.75Å; Y291-S313 VanDerWaalsContact OH-OG 3.08Å; Y291-N315 PolarHBondContact OH-ND2 3.05Å; Y291-T327 HydrophobicContact CD2-CG2 3.92Å; Y291-T327 HydrophobicContact CE2-CG2 3.83Å; Y291-T327 PolarHBondContact N-O 3.44Å
292	L	88	Confident	92.7	Very high	80 Å²	80	63.9 Å²	63.9	42%	0.419	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.4	-177.3	-67.1	167	0	0	0	109	Q289 G290 I299	Q289-L292 HydrophobicContact CB-CD1 4.12Å; G290-L292 PolarHBondContact O-N 2.72Å; L292-I299 PolarHBondContact N-O 2.95Å; L292-I299 PolarHBondContact O-N 2.86Å
293	I	88.5	Confident	92.5	Very high	132 Å²	132	62.3 Å²	62.3	68%	0.677	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	114.6	168	-59.4	172.9	0	0	0	106.2	K297 L298	I293-K297 WeakPolarHBondContact CA-O 3.43Å; I293-L298 HydrophobicContact CG1-CD1 4.02Å
294	K	84.1	Confident	92.3	Very high	130 Å²	130	63.3 Å²	63.3	57%	0.565	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.8	173.5	-168.6	-174.1	173.1	-177.2	0	107.4	G296 K297 I299	K294-G296 PolarHBondContact O-N 2.59Å; K294-K297 PolarHBondContact N-O 2.76Å; K294-K297 PolarHBondContact O-N 3.46Å; K294-I299 HydrophobicContact CB-CD1 3.57Å; K294-I299 HydrophobicContact CB-CG1 4.37Å; K294-I299 HydrophobicContact CD-CD1 4.08Å; K294-I299 HydrophobicContact CG-CD1 4.43Å
295	D	86.7	Confident	92.2	Very high	144 Å²	144	63.9 Å²	63.9	77%	0.77	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	38.7	-179.8	-46.5	-40	0	0	0	113	K297	D295-K297 PolarHBondContact O-N 3.39Å; D295-K297 VanDerWaalsContact O-N 3.13Å
296	G	86.4	Confident	91.9	Very high	73 Å²	73	70.7 Å²	70.7	75%	0.753	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	-5.3	-177	0	0	0	0	0	115.2	K294	K294-G296 PolarHBondContact O-N 2.59Å
297	K	88.2	Confident	91.7	Very high	162 Å²	162	74.8 Å²	74.8	70%	0.704	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	133.9	179.1	-65.1	-178.4	-178.1	177.7	0	111.1	I293 K294 D295 I299	I293-K297 WeakPolarHBondContact CA-O 3.43Å; K294-K297 PolarHBondContact N-O 2.76Å; K294-K297 PolarHBondContact O-N 3.46Å; D295-K297 PolarHBondContact O-N 3.39Å; D295-K297 VanDerWaalsContact O-N 3.13Å; K297-I299 PolarHBondContact O-N 2.89Å
298	L	88.8	Confident	91.5	Very high	91 Å²	91	74.2 Å²	74.2	48%	0.476	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	102.3	176.1	-176.4	58.6	0	0	0	109.8	I293 K300	I293-L298 HydrophobicContact CG1-CD1 4.02Å; L298-K300 HydrophobicContact CD2-CD 4.41Å; L298-K300 HydrophobicContact CG-CD 4.43Å; L298-K300 HydrophobicContact CG-CG 4.02Å
299	I	90	Very high	91.3	Very high	62 Å²	62	81.1 Å²	81.1	32%	0.318	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	117	178	-59.9	-177.5	0	0	0	108.9	L292 K294 K297 N301	L292-I299 PolarHBondContact N-O 2.95Å; L292-I299 PolarHBondContact O-N 2.86Å; K294-I299 HydrophobicContact CB-CD1 3.57Å; K294-I299 HydrophobicContact CB-CG1 4.37Å; K294-I299 HydrophobicContact CD-CD1 4.08Å; K294-I299 HydrophobicContact CG-CD1 4.43Å; K297-I299 PolarHBondContact O-N 2.89Å; I299-N301 WeakPolarHBondContact CG2-OD1 3.45Å
300	K	91.7	Very high	91.1	Very high	90 Å²	90	77.8 Å²	77.8	39%	0.391	41%	0.408	S	S	.	.			trans	-120	-2.6	-179.5	-59.4	-175.6	-175.9	175.1	0	113.9	Y291 L298 N302 S313	Y291-K300 HydrophobicContact CD1-CB 3.91Å; Y291-K300 HydrophobicContact CD1-CG 3.79Å; Y291-K300 HydrophobicContact CD2-CD 4.35Å; Y291-K300 HydrophobicContact CD2-CG 4.18Å; Y291-K300 HydrophobicContact CE1-CB 3.65Å; Y291-K300 HydrophobicContact CE1-CD 4.27Å; Y291-K300 HydrophobicContact CE1-CG 3.8Å; Y291-K300 HydrophobicContact CE2-CD 4Å; Y291-K300 HydrophobicContact CE2-CG 4.18Å; Y291-K300 HydrophobicContact CG-CG 3.99Å; L298-K300 HydrophobicContact CD2-CD 4.41Å; L298-K300 HydrophobicContact CG-CD 4.43Å; L298-K300 HydrophobicContact CG-CG 4.02Å; K300-N302 PolarHBondContact O-N 2.81Å; K300-N302 PolarHBondContact O-OD1 2.91Å; K300-S313 WeakPolarHBondContact O-CA 3.39Å; K300-S313 WeakPolarHBondContact O-CB 3.5Å
301	N	91.3	Very high	91	Very high	69 Å²	69	83.1 Å²	83.1	37%	0.369	43%	0.434	S	S	.	.			trans	-71.2	32.3	-170.8	66.6	-16.2	0	0	0	114.9	I299 A303 S304 D311 K312	I299-N301 WeakPolarHBondContact CG2-OD1 3.45Å; N301-A303 PolarHBondContact O-N 3.11Å; N301-S304 PolarHBondContact O-N 3.06Å; N301-S304 VanDerWaalsContact O-N 3.11Å; N301-S304 PolarHBondContact O-OG 2.9Å; N301-D311 WeakPolarHBondContact CB-OD1 3.24Å; N301-K312 CarbonylContact C-O 3.27Å; N301-K312 VanDerWaalsContact C-O 3.27Å; N301-K312 VanDerWaalsContact CA-O 3.28Å; N301-K312 WeakPolarHBondContact CA-O 3.23Å
302	N	93.8	Very high	91	Very high	14 Å²	14	81.5 Å²	81.5	8%	0.075	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-0.9	-175.2	59.7	17	0	0	0	114.7	K286 Q289 K300 S313 I314 F330	K286-N302 WeakPolarHBondContact CE-O 3.42Å; K286-N302 PolarHBondContact NZ-O 3.28Å; Q289-N302 WeakPolarHBondContact O-CB 3.42Å; Q289-N302 PolarHBondContact O-ND2 3.3Å; K300-N302 PolarHBondContact O-N 2.81Å; K300-N302 PolarHBondContact O-OD1 2.91Å; N302-S313 VanDerWaalsContact OD1-CA 3.31Å; N302-S313 WeakPolarHBondContact OD1-CA 3.35Å; N302-I314 PolarHBondContact OD1-N 3.14Å; N302-F330 HydrophobicContact CB-CE1 4.01Å; N302-F330 HydrophobicContact CB-CZ 4.48Å
303	A	95.5	Very high	91.4	Very high	0 Å²	0	78.7 Å²	78.7	0%	0	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	5.7	171.2	0	0	0	0	0	114.9	N301 K312 S313 I314 I368 T370	N301-A303 PolarHBondContact O-N 3.11Å; A303-K312 HydrophobicContact CB-CG 4.19Å; A303-K312 PolarHBondContact N-O 2.59Å; A303-K312 VanDerWaalsContact N-O 3.09Å; A303-S313 WeakPolarHBondContact CB-O 3.41Å; A303-I314 HydrophobicContact CB-CB 4.32Å; A303-I314 HydrophobicContact CB-CD1 4.28Å; A303-I368 HydrophobicContact CB-CB 4.26Å; A303-I368 HydrophobicContact CB-CD1 4.17Å; A303-I368 HydrophobicContact CB-CG2 4.14Å; A303-T370 HydrophobicContact CB-CG2 4.17Å
304	S	93.9	Very high	91.8	Very high	29 Å²	29	72.4 Å²	72.4	20%	0.203	38%	0.383	C	S	.	.			trans	-67.5	156.3	162.8	65.1	0	0	0	0	110.5	K286 N301	K286-S304 PolarHBondContact NZ-O 3.38Å; N301-S304 PolarHBondContact O-N 3.06Å; N301-S304 VanDerWaalsContact O-N 3.11Å; N301-S304 PolarHBondContact O-OG 2.9Å
305	T	94.6	Very high	92.5	Very high	12 Å²	12	66.8 Å²	66.8	7%	0.074	36%	0.359	C	S	.	.			trans	-133.9	172	175.3	66.6	0	0	0	0	108.8	Y307 D308 L365 K366 I368	T305-Y307 PolarHBondContact O-N 3.3Å; T305-Y307 PolarHBondContact OG1-N 2.66Å; T305-D308 PolarHBondContact N-O 3.37Å; T305-D308 CarbonylContact O-C 3.43Å; T305-D308 PolarHBondContact O-N 2.45Å; T305-D308 VanDerWaalsContact O-O 3.08Å; T305-D308 WeakPolarHBondContact OG1-CB 3.25Å; T305-D308 PolarHBondContact OG1-N 2.78Å; T305-L365 WeakPolarHBondContact CB-O 3.41Å; T305-L365 HydrophobicContact CG2-CB 4.06Å; T305-L365 WeakPolarHBondContact CG2-O 3.23Å; T305-K366 PolarHBondContact OG1-O 2.85Å; T305-I368 HydrophobicContact CG2-CD1 4.27Å; T305-I368 HydrophobicContact CG2-CG1 4.3Å
306	D	93.1	Very high	93	Very high	144 Å²	144	60.1 Å²	60.1	77%	0.77	32%	0.324	S	S	*	.	S	Bend	trans	-66.9	-20.8	178.3	-59.6	-21.5	0	0	0	112.4
307	Y	93.8	Very high	93.5	Very high	132 Å²	132	58 Å²	58	52%	0.518	30%	0.295	S	S	.	.	S	Bend	trans	-98.3	-26.5	178.1	-59	-94.2	0	0	0	113.2	T305 D364 K366	T305-Y307 PolarHBondContact O-N 3.3Å; T305-Y307 PolarHBondContact OG1-N 2.66Å; Y307-D364 VanDerWaalsContact CE2-OD2 3.31Å; Y307-D364 WeakPolarHBondContact CE2-OD2 3.31Å; Y307-D364 PolarHBondContact OH-OD2 3.11Å; Y307-D364 VanDerWaalsContact OH-OD2 3.14Å; Y307-K366 HydrophobicContact CD1-CD 4.4Å; Y307-K366 HydrophobicContact CD1-CG 4.38Å; Y307-K366 HydrophobicContact CD2-CB 4.2Å; Y307-K366 HydrophobicContact CD2-CG 3.72Å; Y307-K366 HydrophobicContact CE1-CD 4.48Å; Y307-K366 HydrophobicContact CE2-CG 3.93Å; Y307-K366 HydrophobicContact CG-CB 4.27Å; Y307-K366 HydrophobicContact CG-CD 4.43Å; Y307-K366 HydrophobicContact CG-CG 3.95Å
308	D	93.5	Very high	93.8	Very high	22 Å²	22	54.5 Å²	54.5	12%	0.118	31%	0.305	C	S	.	.			trans	-119	93.4	179.2	178.7	14.1	0	0	0	109.4	T305 S310 K312 F367	T305-D308 PolarHBondContact N-O 3.37Å; T305-D308 CarbonylContact O-C 3.43Å; T305-D308 PolarHBondContact O-N 2.45Å; T305-D308 VanDerWaalsContact O-O 3.08Å; T305-D308 WeakPolarHBondContact OG1-CB 3.25Å; T305-D308 PolarHBondContact OG1-N 2.78Å; D308-S310 PolarHBondContact O-N 2.75Å; D308-S310 WeakPolarHBondContact OD1-CB 3.4Å; D308-S310 PolarHBondContact OD1-N 3.19Å; D308-S310 PolarHBondContact OD1-OG 2.81Å; D308-K312 WeakPolarHBondContact OD2-CE 3.24Å; D308-K312 IonicContact OD2-NZ 2.9Å; D308-K312 PolarHBondContact OD2-NZ 2.85Å; D308-F367 HydrophobicContact CB-CD2 4.35Å; D308-F367 WeakPolarHBondContact OD2-CD2 3.46Å; D308-F367 WeakPolarHBondContact OD2-CE2 3.3Å
309	L	92.2	Very high	94.2	Very high	147 Å²	147	50.5 Å²	50.5	77%	0.77	29%	0.285	S	S	*	.			trans	-77.9	3.6	-176.5	-56.1	179.5	0	0	0	113.5	D311	L309-D311 PolarHBondContact O-N 2.73Å
310	S	91.5	Very high	94.6	Very high	49 Å²	49	47.8 Å²	47.8	34%	0.343	27%	0.271	S	S	.	.			trans	-56.9	126	177.2	-55.1	0	0	0	0	110.6	D308 K312	D308-S310 PolarHBondContact O-N 2.75Å; D308-S310 WeakPolarHBondContact OD1-CB 3.4Å; D308-S310 PolarHBondContact OD1-N 3.19Å; D308-S310 PolarHBondContact OD1-OG 2.81Å; S310-K312 PolarHBondContact O-N 2.77Å
311	D	90.8	Very high	94.8	Very high	119 Å²	119	45.2 Å²	45.2	64%	0.636	26%	0.263	S	S	*	.			trans	-71.8	92	173.8	-175.2	1.6	0	0	0	109.9	N301 L309	N301-D311 WeakPolarHBondContact CB-OD1 3.24Å; L309-D311 PolarHBondContact O-N 2.73Å
312	K	94.4	Very high	95.1	Very high	10 Å²	10	48.2 Å²	48.2	4%	0.043	27%	0.274	C	S	.	.			trans	-142.6	146.2	-177	67.6	-171	-179.5	172.5	0	112.4	N301 A303 D308 S310 I368 T370 T381	N301-K312 CarbonylContact C-O 3.27Å; N301-K312 VanDerWaalsContact C-O 3.27Å; N301-K312 VanDerWaalsContact CA-O 3.28Å; N301-K312 WeakPolarHBondContact CA-O 3.23Å; A303-K312 HydrophobicContact CB-CG 4.19Å; A303-K312 PolarHBondContact N-O 2.59Å; A303-K312 VanDerWaalsContact N-O 3.09Å; D308-K312 WeakPolarHBondContact OD2-CE 3.24Å; D308-K312 IonicContact OD2-NZ 2.9Å; D308-K312 PolarHBondContact OD2-NZ 2.85Å; S310-K312 PolarHBondContact O-N 2.77Å; K312-I368 PolarHBondContact NZ-O 3.49Å; K312-T370 HydrophobicContact CD-CG2 4.08Å; K312-T370 WeakPolarHBondContact CD-OG1 3.22Å; K312-T370 HydrophobicContact CG-CG2 4.37Å; K312-T381 HydrophobicContact CB-CG2 4.01Å; K312-T381 HydrophobicContact CD-CG2 4.47Å
313	S	96.1	Very high	95.2	Very high	21 Å²	21	47.8 Å²	47.8	15%	0.147	27%	0.272	C	S	.	.			trans	-88.8	165.4	173	79.6	0	0	0	0	112.1	Y291 K300 N302 A303 N315 T370	Y291-S313 WeakPolarHBondContact OH-CB 3.49Å; Y291-S313 PolarHBondContact OH-OG 2.75Å; Y291-S313 VanDerWaalsContact OH-OG 3.08Å; K300-S313 WeakPolarHBondContact O-CA 3.39Å; K300-S313 WeakPolarHBondContact O-CB 3.5Å; N302-S313 VanDerWaalsContact OD1-CA 3.31Å; N302-S313 WeakPolarHBondContact OD1-CA 3.35Å; A303-S313 WeakPolarHBondContact CB-O 3.41Å; S313-N315 PolarHBondContact O-N 3.26Å; S313-N315 WeakPolarHBondContact OG-CB 3.4Å; S313-N315 PolarHBondContact OG-N 3.4Å; S313-T370 WeakPolarHBondContact O-CG2 3.41Å
314	I	97.4	Very high	95.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	-61.5	-12.7	175.4	-164.8	57	0	0	0	113.5	I78 N302 A303 P316 V326 F330 M332 I368	I78-I314 HydrophobicContact CD1-CD1 3.83Å; I78-I314 HydrophobicContact CD1-CG1 3.94Å; I78-I314 HydrophobicContact CG1-CD1 4.28Å; I78-I314 HydrophobicContact CG1-CG1 4.01Å; I78-I314 HydrophobicContact CG2-CG1 4.13Å; N302-I314 PolarHBondContact OD1-N 3.14Å; A303-I314 HydrophobicContact CB-CB 4.32Å; A303-I314 HydrophobicContact CB-CD1 4.28Å; I314-P316 WeakPolarHBondContact O-CD 2.87Å; I314-V326 HydrophobicContact CG2-CB 3.96Å; I314-V326 HydrophobicContact CG2-CG1 4.02Å; I314-F330 HydrophobicContact CB-CE1 3.9Å; I314-F330 HydrophobicContact CB-CE2 4.29Å; I314-F330 HydrophobicContact CB-CZ 3.72Å; I314-F330 HydrophobicContact CD1-CE2 4.08Å; I314-F330 HydrophobicContact CD1-CZ 4.14Å; I314-F330 HydrophobicContact CG1-CD2 4.29Å; I314-F330 HydrophobicContact CG1-CE1 4.24Å; I314-F330 HydrophobicContact CG1-CE2 3.74Å; I314-F330 HydrophobicContact CG1-CZ 3.69Å; I314-F330 HydrophobicContact CG2-CD1 3.99Å; I314-F330 HydrophobicContact CG2-CE1 3.7Å; I314-F330 HydrophobicContact CG2-CZ 4.04Å; I314-M332 HydrophobicContact CD1-CE 3.75Å; I314-I368 HydrophobicContact CD1-CG2 3.61Å
315	N	97.7	Very high	95.4	Very high	12 Å²	12	52.8 Å²	52.8	6%	0.064	30%	0.3	C	S	.	.	S	Bend	trans	-76.1	124.3	179	-66.7	-52.9	0	0	0	110.9	Y291 S313 E325 V326	Y291-N315 PolarHBondContact OH-ND2 3.05Å; S313-N315 PolarHBondContact O-N 3.26Å; S313-N315 WeakPolarHBondContact OG-CB 3.4Å; S313-N315 PolarHBondContact OG-N 3.4Å; N315-E325 WeakPolarHBondContact OD1-CA 3.07Å; N315-V326 PolarHBondContact ND2-N 3.46Å; N315-V326 PolarHBondContact ND2-O 3.13Å; N315-V326 PolarHBondContact OD1-N 2.85Å
316	P	97.5	Very high	95.5	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.026	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-52.9	156	165.2	-30.7	39.3	0	0	0	112.6	I314 G318 G319 F320 T370 T371 K373	I314-P316 WeakPolarHBondContact O-CD 2.87Å; P316-G318 PolarHBondContact O-N 2.77Å; P316-G318 VanDerWaalsContact O-N 3.15Å; P316-G319 WeakPolarHBondContact O-CA 3.24Å; P316-G319 PolarHBondContact O-N 2.82Å; P316-F320 HydrophobicContact CG-CD1 3.93Å; P316-F320 HydrophobicContact CG-CE1 3.75Å; P316-F320 HydrophobicContact CG-CE2 4.42Å; P316-F320 HydrophobicContact CG-CG 4.35Å; P316-F320 HydrophobicContact CG-CZ 4Å; P316-T370 CarbonylContact C-O 3.54Å; P316-T370 WeakPolarHBondContact CA-O 3.47Å; P316-T371 WeakPolarHBondContact CB-O 3.34Å; P316-K373 HydrophobicContact CB-CG 4.02Å; P316-K373 HydrophobicContact CG-CG 3.79Å
317	L	96.6	Very high	95.7	Very high	30 Å²	30	47.7 Å²	47.7	16%	0.157	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	122.5	166.8	-65.2	-175.5	0	0	0	111	T370 S372 F379 M382	L317-T370 PolarHBondContact N-O 3.44Å; L317-S372 WeakPolarHBondContact O-CA 3.31Å; L317-S372 WeakPolarHBondContact O-CB 3.45Å; L317-F379 HydrophobicContact CD1-CB 4.1Å; L317-F379 VanDerWaalsContact CD1-O 3.26Å; L317-F379 WeakPolarHBondContact CD1-O 3.15Å; L317-M382 HydrophobicContact CD2-CG 3.73Å; L317-M382 HydrophobicContact CD2-SD 4.22Å
318	G	95.4	Very high	95.8	Very high	88 Å²	88	42.5 Å²	42.5	91%	0.907	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	7.5	-173.3	0	0	0	0	0	115.2	P316	P316-G318 PolarHBondContact O-N 2.77Å; P316-G318 VanDerWaalsContact O-N 3.15Å
319	G	96.9	Very high	96.1	Very high	6 Å²	6	43 Å²	43	6%	0.062	26%	0.258	C	S	.	.			trans	74.5	176.5	-177.2	0	0	0	0	0	113.7	P316 V321	P316-G319 WeakPolarHBondContact O-CA 3.24Å; P316-G319 PolarHBondContact O-N 2.82Å; G319-V321 PolarHBondContact O-N 3.25Å
320	F	97.9	Very high	96.4	Very high	6 Å²	6	36 Å²	36	3%	0.026	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-69.4	125.6	173.6	-78.3	-76	0	0	0	110.3	A51 I78 P316 H322 Y323 G324 V326	A51-F320 HydrophobicContact CB-CD2 4.17Å; A51-F320 HydrophobicContact CB-CG 4.47Å; I78-F320 HydrophobicContact CB-CE2 4.4Å; I78-F320 HydrophobicContact CB-CZ 4.02Å; I78-F320 HydrophobicContact CG1-CE1 4.37Å; I78-F320 HydrophobicContact CG1-CE2 4.41Å; I78-F320 HydrophobicContact CG1-CZ 3.68Å; I78-F320 HydrophobicContact CG2-CE2 4.4Å; I78-F320 HydrophobicContact CG2-CZ 4.46Å; P316-F320 HydrophobicContact CG-CD1 3.93Å; P316-F320 HydrophobicContact CG-CE1 3.75Å; P316-F320 HydrophobicContact CG-CE2 4.42Å; P316-F320 HydrophobicContact CG-CG 4.35Å; P316-F320 HydrophobicContact CG-CZ 4Å; F320-H322 PolarHBondContact O-N 2.99Å; F320-Y323 HydrophobicContact CB-CD1 4.48Å; F320-Y323 PolarHBondContact O-N 3.25Å; F320-G324 PolarHBondContact N-O 3.5Å; F320-G324 PolarHBondContact O-N 3.49Å; F320-V326 HydrophobicContact CD2-CG2 3.85Å; F320-V326 HydrophobicContact CE2-CG2 3.87Å
321	V	97.2	Very high	96.7	Very high	35 Å²	35	33.7 Å²	33.7	21%	0.212	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	125.1	-176.9	-175.4	0	0	0	0	111.2	G319 Y323 K341 K373 F374	G319-V321 PolarHBondContact O-N 3.25Å; V321-Y323 PolarHBondContact O-N 3.13Å; V321-K341 WeakPolarHBondContact O-CD 3.3Å; V321-K341 WeakPolarHBondContact O-CE 3.25Å; V321-K341 PolarHBondContact O-NZ 2.96Å; V321-K373 HydrophobicContact CG2-CB 4.05Å; V321-K373 WeakPolarHBondContact CG2-O 3.45Å; V321-F374 HydrophobicContact CG1-CD2 3.89Å; V321-F374 HydrophobicContact CG2-CB 3.91Å; V321-F374 HydrophobicContact CG2-CD2 4.2Å
322	H	96.3	Very high	97.1	Very high	132 Å²	132	28 Å²	28	61%	0.611	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.2	37	-173	-30.7	-44.6	0	0	0	114	F320 K341 K342	F320-H322 PolarHBondContact O-N 2.99Å; H322-K341 HydrophobicContact CB-CD 4.01Å; H322-K341 WeakPolarHBondContact CD2-CE 3.2Å; H322-K341 PolarHBondContact CD2-NZ 3.12Å; H322-K342 WeakPolarHBondContact O-CE 3.21Å
323	Y	97.5	Very high	97.3	Very high	6 Å²	6	27.5 Å²	27.5	2%	0.024	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.6	-54.2	165.2	-174.7	-95.8	0	0	0	109.2	A51 E80 P172 L173 F320 V321 V326 K342	A51-Y323 HydrophobicContact CB-CD1 3.66Å; A51-Y323 HydrophobicContact CB-CD2 4.28Å; A51-Y323 HydrophobicContact CB-CE1 3.57Å; A51-Y323 HydrophobicContact CB-CE2 4.19Å; A51-Y323 HydrophobicContact CB-CG 4.02Å; A51-Y323 WeakPolarHBondContact O-CB 3.33Å; E80-Y323 WeakPolarHBondContact OE2-CE1 3.37Å; E80-Y323 VanDerWaalsContact OE2-CZ 3.25Å; E80-Y323 PolarHBondContact OE2-OH 2.8Å; P172-Y323 HydrophobicContact CG-CD1 4.29Å; P172-Y323 HydrophobicContact CG-CE1 3.96Å; L173-Y323 HydrophobicContact CD2-CE2 4.31Å; F320-Y323 HydrophobicContact CB-CD1 4.48Å; F320-Y323 PolarHBondContact O-N 3.25Å; V321-Y323 PolarHBondContact O-N 3.13Å; Y323-V326 HydrophobicContact CD1-CG2 4.48Å; Y323-V326 HydrophobicContact CE1-CG2 4.1Å; Y323-K342 HydrophobicContact CD2-CB 4.42Å; Y323-K342 HydrophobicContact CD2-CG 3.77Å; Y323-K342 HydrophobicContact CE2-CG 4.38Å
324	G	96.3	Very high	97.4	Very high	29 Å²	29	28.6 Å²	28.6	30%	0.299	18%	0.175	S	C	.	.	B	Isolated β-bridge	trans	113.5	-154.7	-169.6	0	0	0	0	0	109.8	F320	F320-G324 PolarHBondContact N-O 3.5Å; F320-G324 PolarHBondContact O-N 3.49Å
325	E	96.4	Very high	97.4	Very high	104 Å²	104	29.6 Å²	29.6	49%	0.486	18%	0.184	S	C	.	.			trans	-90.6	143.3	176.7	-64.3	-179.7	164.3	0	0	111	N315 T327	N315-E325 WeakPolarHBondContact OD1-CA 3.07Å; E325-T327 HydrophobicContact CB-CG2 4.15Å
326	V	97.6	Very high	97.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	21%	0.205	C	C	.	.			trans	-86.6	111.4	166.5	176	0	0	0	0	106.6	A51 I78 E80 I314 N315 F320 Y323 F330	A51-V326 HydrophobicContact CB-CG2 3.45Å; A51-V326 VanDerWaalsContact CB-CG2 3.45Å; I78-V326 HydrophobicContact CG2-CG2 4.22Å; E80-V326 HydrophobicContact CB-CG1 4.08Å; E80-V326 HydrophobicContact CB-CG2 4.44Å; E80-V326 HydrophobicContact CG-CG1 3.94Å; I314-V326 HydrophobicContact CG2-CB 3.96Å; I314-V326 HydrophobicContact CG2-CG1 4.02Å; N315-V326 PolarHBondContact ND2-N 3.46Å; N315-V326 PolarHBondContact ND2-O 3.13Å; N315-V326 PolarHBondContact OD1-N 2.85Å; F320-V326 HydrophobicContact CD2-CG2 3.85Å; F320-V326 HydrophobicContact CE2-CG2 3.87Å; Y323-V326 HydrophobicContact CD1-CG2 4.48Å; Y323-V326 HydrophobicContact CE1-CG2 4.1Å; V326-F330 HydrophobicContact CG1-CB 3.93Å; V326-F330 HydrophobicContact CG1-CD1 4.07Å; V326-F330 HydrophobicContact CG1-CG 4.26Å
327	T	96.5	Very high	97.5	Very high	49 Å²	49	32.6 Å²	32.6	30%	0.301	21%	0.205	S	C	.	.			trans	-114.7	-17.6	-176.7	59.9	0	0	0	0	112.3	E80 G290 Y291 E325	E80-T327 PolarHBondContact OE1-N 3.2Å; G290-T327 CarbonylContact C-O 3.55Å; G290-T327 VanDerWaalsContact CA-O 3.29Å; G290-T327 WeakPolarHBondContact CA-O 3.38Å; Y291-T327 HydrophobicContact CD2-CG2 3.92Å; Y291-T327 HydrophobicContact CE2-CG2 3.83Å; Y291-T327 PolarHBondContact N-O 3.44Å; E325-T327 HydrophobicContact CB-CG2 4.15Å
328	N	97.1	Very high	97.5	Very high	24 Å²	24	31.4 Å²	31.4	13%	0.128	20%	0.199	C	C	.	.	S	Bend	trans	-94.5	175	174.9	-56	-87.9	0	0	0	110.9	E80 P82 L170 G290	E80-N328 HydrophobicContact CG-CB 3.96Å; E80-N328 PolarHBondContact OE1-N 3.48Å; E80-N328 PolarHBondContact OE1-ND2 2.95Å; P82-N328 HydrophobicContact CB-CB 4.28Å; P82-N328 HydrophobicContact CG-CB 4.22Å; L170-N328 PolarHBondContact O-ND2 3.21Å; G290-N328 WeakPolarHBondContact CA-O 3.32Å
329	D	97.9	Very high	97.6	Very high	32 Å²	32	27.9 Å²	27.9	17%	0.171	16%	0.163	C	C	.	.			trans	-49.3	147.8	169.2	-62.3	-10.9	0	0	0	110.8	T81 V207 G288 Q289 G290	T81-D329 CarbonylContact C-O 3.6Å; T81-D329 WeakPolarHBondContact CA-O 3.41Å; T81-D329 PolarHBondContact N-O 2.64Å; T81-D329 PolarHBondContact OG1-O 2.74Å; V207-D329 HydrophobicContact CG1-CB 4.16Å; G288-D329 CarbonylContact O-C 3.43Å; G288-D329 VanDerWaalsContact O-CA 3.27Å; G288-D329 WeakPolarHBondContact O-CA 3.34Å; Q289-D329 WeakPolarHBondContact CA-OD1 3.33Å; G290-D329 PolarHBondContact N-OD1 2.85Å
330	F	98.5	Very high	97.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	156	179.4	66.9	-88.8	0	0	0	112	I78 V79 T81 I287 G288 N302 I314 V326 M332	I78-F330 HydrophobicContact CG2-CB 4.09Å; I78-F330 HydrophobicContact CG2-CD2 3.93Å; I78-F330 HydrophobicContact CG2-CG 4.13Å; V79-F330 CarbonylContact O-C 3.47Å; V79-F330 VanDerWaalsContact O-CA 3.27Å; V79-F330 WeakPolarHBondContact O-CA 3.43Å; V79-F330 WeakPolarHBondContact O-CB 3.05Å; T81-F330 WeakPolarHBondContact OG1-CA 3.3Å; I287-F330 CarbonylContact C-O 3.55Å; G288-F330 PolarHBondContact N-O 2.85Å; G288-F330 PolarHBondContact O-N 3.16Å; N302-F330 HydrophobicContact CB-CE1 4.01Å; N302-F330 HydrophobicContact CB-CZ 4.48Å; I314-F330 HydrophobicContact CB-CE1 3.9Å; I314-F330 HydrophobicContact CB-CE2 4.29Å; I314-F330 HydrophobicContact CB-CZ 3.72Å; I314-F330 HydrophobicContact CD1-CE2 4.08Å; I314-F330 HydrophobicContact CD1-CZ 4.14Å; I314-F330 HydrophobicContact CG1-CD2 4.29Å; I314-F330 HydrophobicContact CG1-CE1 4.24Å; I314-F330 HydrophobicContact CG1-CE2 3.74Å; I314-F330 HydrophobicContact CG1-CZ 3.69Å; I314-F330 HydrophobicContact CG2-CD1 3.99Å; I314-F330 HydrophobicContact CG2-CE1 3.7Å; I314-F330 HydrophobicContact CG2-CZ 4.04Å; V326-F330 HydrophobicContact CG1-CB 3.93Å; V326-F330 HydrophobicContact CG1-CD1 4.07Å; V326-F330 HydrophobicContact CG1-CG 4.26Å; F330-M332 HydrophobicContact CE2-CB 4.43Å
331	V	98.5	Very high	97.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	123.3	170.7	-175.5	0	0	0	0	108.7	V79 T81 V207 I284 L333 L347	V79-V331 PolarHBondContact N-O 2.68Å; V79-V331 PolarHBondContact O-N 3.06Å; T81-V331 HydrophobicContact CG2-CG2 4.05Å; V207-V331 HydrophobicContact CG1-CG2 4.21Å; V207-V331 HydrophobicContact CG2-CG2 3.61Å; I284-V331 HydrophobicContact CB-CG1 4.4Å; I284-V331 HydrophobicContact CD1-CG1 4.03Å; I284-V331 HydrophobicContact CG1-CG1 3.76Å; I284-V331 HydrophobicContact CG2-CG1 3.96Å; V331-L333 HydrophobicContact CG1-CD2 3.59Å; V331-L333 HydrophobicContact CG1-CG 3.91Å; V331-L347 HydrophobicContact CB-CD1 4.47Å; V331-L347 HydrophobicContact CG2-CD1 4.23Å
332	M	98.7	Very high	97.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	114	170.8	-178.1	-173.4	-70.3	0	0	109.2	I56 V76 I78 Y285 K286 I314 F330 L365 I368	I56-M332 HydrophobicContact CG2-CE 3.98Å; I56-M332 HydrophobicContact CG2-SD 3.7Å; V76-M332 HydrophobicContact CB-CG 3.64Å; V76-M332 HydrophobicContact CB-SD 4.18Å; V76-M332 HydrophobicContact CG1-CG 3.9Å; V76-M332 HydrophobicContact CG1-SD 4.02Å; V76-M332 HydrophobicContact CG2-CE 4.37Å; V76-M332 HydrophobicContact CG2-CG 3.78Å; V76-M332 HydrophobicContact CG2-SD 3.93Å; I78-M332 HydrophobicContact CD1-CB 3.97Å; I78-M332 HydrophobicContact CD1-CE 3.88Å; I78-M332 HydrophobicContact CD1-CG 3.78Å; Y285-M332 PolarHBondContact N-O 3.26Å; K286-M332 HydrophobicContact CB-CB 4.01Å; K286-M332 HydrophobicContact CB-SD 4.33Å; K286-M332 PolarHBondContact O-N 3.48Å; I314-M332 HydrophobicContact CD1-CE 3.75Å; F330-M332 HydrophobicContact CE2-CB 4.43Å; M332-L365 HydrophobicContact CE-CD1 4.46Å; M332-L365 HydrophobicContact SD-CD1 3.98Å; M332-I368 HydrophobicContact CE-CD1 3.8Å; M332-I368 HydrophobicContact CE-CG1 4.08Å; M332-I368 HydrophobicContact CE-CG2 4.1Å
333	L	98.6	Very high	97.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.7	-177.2	-63.8	174.4	0	0	0	111.6	V76 T77 V79 I217 V219 I284 V331 G335 V337 L347	V76-L333 CarbonylContact C-O 3.56Å; V76-L333 VanDerWaalsContact CA-O 3.25Å; V76-L333 WeakPolarHBondContact CA-O 3.28Å; T77-L333 PolarHBondContact N-O 3.48Å; T77-L333 PolarHBondContact O-N 3.09Å; V79-L333 HydrophobicContact CG2-CD1 3.99Å; I217-L333 HydrophobicContact CD1-CD1 4.22Å; I217-L333 HydrophobicContact CD1-CD2 3.58Å; I217-L333 HydrophobicContact CG1-CD2 3.89Å; V219-L333 HydrophobicContact CG2-CD1 3.68Å; I284-L333 HydrophobicContact CG1-CD2 3.68Å; V331-L333 HydrophobicContact CG1-CD2 3.59Å; V331-L333 HydrophobicContact CG1-CG 3.91Å; L333-G335 PolarHBondContact O-N 2.81Å; L333-V337 HydrophobicContact CB-CG1 4.28Å; L333-V337 HydrophobicContact CD1-CG1 3.94Å; L333-L347 HydrophobicContact CD1-CD2 4.1Å
334	K	98.4	Very high	97.7	Very high	44 Å²	44	30.1 Å²	30.1	19%	0.191	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	125.2	174.1	-172.9	-167.5	-177.5	101.8	0	111.4	E74 K283 Y285	E74-K334 VanDerWaalsContact CD-NZ 3.3Å; E74-K334 IonicContact OE1-NZ 3.63Å; E74-K334 PolarHBondContact OE1-NZ 2.97Å; E74-K334 IonicContact OE2-NZ 2.81Å; E74-K334 PolarHBondContact OE2-NZ 2.85Å; K283-K334 HydrophobicContact CB-CB 4.19Å; K283-K334 PolarHBondContact O-N 2.92Å; Y285-K334 HydrophobicContact CD1-CB 4.26Å; Y285-K334 HydrophobicContact CE1-CB 3.76Å; Y285-K334 HydrophobicContact CE1-CD 4.24Å; Y285-K334 HydrophobicContact CE1-CG 4.1Å; Y285-K334 HydrophobicContact CE2-CB 4.27Å; Y285-K334 HydrophobicContact CE2-CG 4.19Å; Y285-K334 WeakPolarHBondContact OH-CD 3.43Å; Y285-K334 WeakPolarHBondContact OH-CG 3.48Å; Y285-K334 PolarHBondContact OH-NZ 3.27Å
335	G	98.2	Very high	97.8	Very high	20 Å²	20	28.7 Å²	28.7	21%	0.206	16%	0.155	C	C	.	.	S	Bend	trans	74	-162.8	173.2	0	0	0	0	0	114.1	A75 T77 L333	A75-G335 WeakPolarHBondContact O-CA 3.34Å; A75-G335 PolarHBondContact O-N 2.89Å; T77-G335 PolarHBondContact N-O 3.05Å; T77-G335 PolarHBondContact OG1-O 3.4Å; L333-G335 PolarHBondContact O-N 2.81Å
336	C	98.1	Very high	97.9	Very high	73 Å²	73	23.8 Å²	23.8	49%	0.493	13%	0.132	S	C	.	.			trans	-76.7	154.2	175.8	67.7	0	0	0	0	111.5	M53 K282	M53-C336 HydrophobicContact CE-CB 3.95Å; M53-C336 HydrophobicContact SD-CB 4.18Å; K282-C336 PolarHBondContact NZ-O 2.93Å
337	V	98.3	Very high	98	Very high	6 Å²	6	23.8 Å²	23.8	4%	0.036	13%	0.132	C	C	.	.			trans	-125.4	160.2	166.6	-54.1	0	0	0	0	111.1	K50 T77 V219 L333 L345	K50-V337 HydrophobicContact CD-CG2 3.76Å; K50-V337 HydrophobicContact CG-CG2 4.37Å; K50-V337 PolarHBondContact NZ-O 3.08Å; T77-V337 HydrophobicContact CG2-CG2 3.69Å; T77-V337 PolarHBondContact OG1-N 2.79Å; V219-V337 HydrophobicContact CG1-CB 4.06Å; V219-V337 HydrophobicContact CG1-CG1 4.34Å; V219-V337 HydrophobicContact CG2-CG1 4.14Å; L333-V337 HydrophobicContact CB-CG1 4.28Å; L333-V337 HydrophobicContact CD1-CG1 3.94Å; V337-L345 HydrophobicContact CB-CD1 4.35Å; V337-L345 HydrophobicContact CG2-CD1 3.46Å; V337-L345 VanDerWaalsContact CG2-CD1 3.46Å
338	V	97.6	Very high	98.1	Very high	5 Å²	5	22 Å²	22	3%	0.03	12%	0.12	C	C	.	.	S	Bend	trans	-50.8	142.6	177	21.2	0	0	0	0	112.3	V219 V222 T223 E279 L345	V219-V338 HydrophobicContact CG1-CG1 4.17Å; V222-V338 WeakPolarHBondContact O-CG2 3.31Å; T223-V338 HydrophobicContact CG2-CG2 4.27Å; E279-V338 HydrophobicContact CG-CG1 3.98Å; E279-V338 WeakPolarHBondContact OE1-CA 3.43Å; E279-V338 WeakPolarHBondContact OE1-CB 3.01Å; E279-V338 PolarHBondContact OE1-N 2.91Å; V338-L345 VanDerWaalsContact O-CD2 3.24Å; V338-L345 WeakPolarHBondContact O-CD2 3.39Å
339	G	97.1	Very high	98.1	Very high	14 Å²	14	22.7 Å²	22.7	14%	0.144	12%	0.122	C	C	.	.	S	Bend	trans	94.8	175.7	169.9	0	0	0	0	0	115.6	K50 V222	K50-G339 PolarHBondContact NZ-O 3.49Å; V222-G339 VanDerWaalsContact O-CA 3.32Å; V222-G339 WeakPolarHBondContact O-CA 3.38Å
340	T	97.2	Very high	98.1	Very high	43 Å²	43	22 Å²	22	26%	0.264	12%	0.119	S	C	.	.			trans	-89.4	166.7	174.8	53.5	0	0	0	0	110.5	K224 R343	K224-T340 HydrophobicContact CB-CG2 3.81Å; K224-T340 HydrophobicContact CD-CG2 3.79Å; K224-T340 HydrophobicContact CG-CG2 3.52Å; T340-R343 WeakPolarHBondContact O-CB 3.35Å; T340-R343 PolarHBondContact O-N 3.24Å; T340-R343 PolarHBondContact OG1-NE 3.27Å; T340-R343 PolarHBondContact OG1-NH2 2.65Å
341	K	96.3	Very high	98	Very high	71 Å²	71	25.8 Å²	25.8	31%	0.309	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	155.1	159.4	54.7	-174.7	165.2	-169.9	0	112.1	K50 A51 V321 H322 R343	K50-K341 CarbonylContact O-C 3.48Å; K50-K341 VanDerWaalsContact O-CA 3.25Å; K50-K341 WeakPolarHBondContact O-CA 3.33Å; A51-K341 WeakPolarHBondContact O-CB 3.41Å; V321-K341 WeakPolarHBondContact O-CD 3.3Å; V321-K341 WeakPolarHBondContact O-CE 3.25Å; V321-K341 PolarHBondContact O-NZ 2.96Å; H322-K341 HydrophobicContact CB-CD 4.01Å; H322-K341 WeakPolarHBondContact CD2-CE 3.2Å; H322-K341 PolarHBondContact CD2-NZ 3.12Å; K341-R343 PolarHBondContact O-N 3.27Å
342	K	97.9	Very high	97.8	Very high	97 Å²	97	30.1 Å²	30.1	42%	0.422	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	0.2	-172.6	-51.1	-173.8	178.7	-150.3	0	115.6	K50 L173 H322 Y323	K50-K342 PolarHBondContact O-N 3.05Å; L173-K342 HydrophobicContact CD2-CB 3.78Å; L173-K342 HydrophobicContact CD2-CD 3.6Å; L173-K342 HydrophobicContact CD2-CG 3.56Å; H322-K342 WeakPolarHBondContact O-CE 3.21Å; Y323-K342 HydrophobicContact CD2-CB 4.42Å; Y323-K342 HydrophobicContact CD2-CG 3.77Å; Y323-K342 HydrophobicContact CE2-CG 4.38Å
343	R	97.9	Very high	97.6	Very high	20 Å²	20	36.4 Å²	36.4	8%	0.075	20%	0.2	C	C	.	.			trans	-84.9	135	-175.2	-167.4	167.6	-56	-153.5	-7.8	110.9	Y49 K50 V222 T223 T340 K341 L345	Y49-R343 WeakPolarHBondContact CA-O 3.39Å; K50-R343 PolarHBondContact N-O 2.96Å; V222-R343 WeakPolarHBondContact O-CD 3.49Å; V222-R343 PolarHBondContact O-NH1 2.67Å; T223-R343 PolarHBondContact O-NH1 2.8Å; T340-R343 WeakPolarHBondContact O-CB 3.35Å; T340-R343 PolarHBondContact O-N 3.24Å; T340-R343 PolarHBondContact OG1-NE 3.27Å; T340-R343 PolarHBondContact OG1-NH2 2.65Å; K341-R343 PolarHBondContact O-N 3.27Å; R343-L345 PolarHBondContact O-N 2.85Å
344	V	98.4	Very high	97.4	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	128	168.5	63.3	0	0	0	0	110.5	R26 L47 G48 Y49 H179	R26-V344 HydrophobicContact CB-CG1 3.82Å; R26-V344 HydrophobicContact CG-CG1 3.93Å; R26-V344 HydrophobicContact CG-CG2 4.17Å; L47-V344 HydrophobicContact CB-CG2 4.34Å; L47-V344 HydrophobicContact CD1-CG2 4.41Å; L47-V344 HydrophobicContact CD2-CG2 4.31Å; G48-V344 CarbonylContact O-C 3.59Å; G48-V344 WeakPolarHBondContact O-CA 3.5Å; Y49-V344 HydrophobicContact CD1-CB 4.16Å; Y49-V344 HydrophobicContact CE1-CB 3.79Å; Y49-V344 HydrophobicContact CE1-CG2 4.19Å; H179-V344 HydrophobicContact CB-CG2 4.44Å
345	L	98.6	Very high	97.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	141	174.1	-58.8	-179.7	0	0	0	108.3	L47 G48 K50 V79 V219 V337 V338 R343	L47-L345 WeakPolarHBondContact CA-O 3.36Å; G48-L345 PolarHBondContact N-O 3.29Å; G48-L345 PolarHBondContact O-N 3.42Å; K50-L345 HydrophobicContact CB-CD1 3.93Å; K50-L345 HydrophobicContact CB-CG 4.44Å; V79-L345 HydrophobicContact CG2-CD1 4.11Å; V219-L345 HydrophobicContact CG1-CB 4.18Å; V219-L345 HydrophobicContact CG1-CD1 4Å; V219-L345 HydrophobicContact CG1-CG 4.46Å; V337-L345 HydrophobicContact CB-CD1 4.35Å; V337-L345 HydrophobicContact CG2-CD1 3.46Å; V337-L345 VanDerWaalsContact CG2-CD1 3.46Å; V338-L345 VanDerWaalsContact O-CD2 3.24Å; V338-L345 WeakPolarHBondContact O-CD2 3.39Å; R343-L345 PolarHBondContact O-N 2.85Å
346	T	98.8	Very high	97.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	111.7	172.3	-51.3	0	0	0	0	107.6	R26 G27 V29 F46 L47 M181 I220	R26-T346 WeakPolarHBondContact CG-OG1 3.36Å; G27-T346 PolarHBondContact O-OG1 3.27Å; V29-T346 HydrophobicContact CG2-CG2 3.46Å; V29-T346 VanDerWaalsContact CG2-CG2 3.46Å; F46-T346 CarbonylContact O-C 3.52Å; F46-T346 WeakPolarHBondContact O-CA 3.32Å; L47-T346 HydrophobicContact CD2-CG2 3.91Å; L47-T346 WeakPolarHBondContact CD2-OG1 3.32Å; M181-T346 HydrophobicContact CE-CG2 3.76Å; M181-T346 HydrophobicContact SD-CG2 4.14Å; I220-T346 PolarHBondContact N-O 2.9Å; I220-T346 PolarHBondContact O-N 3.34Å
347	L	98.7	Very high	96.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	134.1	172.4	-52.7	-175.7	0	0	0	107.3	A45 F46 T81 F211 I217 V219 V331 L333	A45-L347 CarbonylContact C-O 3.52Å; A45-L347 WeakPolarHBondContact CA-O 3.37Å; A45-L347 VanDerWaalsContact CB-O 3.24Å; A45-L347 WeakPolarHBondContact CB-O 3.4Å; F46-L347 HydrophobicContact CB-CB 4.5Å; F46-L347 PolarHBondContact N-O 2.9Å; F46-L347 PolarHBondContact O-N 3.38Å; T81-L347 HydrophobicContact CG2-CD1 4.23Å; F211-L347 HydrophobicContact CE2-CB 3.59Å; F211-L347 HydrophobicContact CE2-CD1 4.31Å; F211-L347 HydrophobicContact CZ-CB 3.74Å; I217-L347 HydrophobicContact CD1-CB 4.02Å; I217-L347 HydrophobicContact CD1-CD1 4.22Å; I217-L347 HydrophobicContact CD1-CD2 3.87Å; I217-L347 HydrophobicContact CD1-CG 4.24Å; V219-L347 HydrophobicContact CG1-CD2 4.14Å; V219-L347 HydrophobicContact CG2-CD2 3.96Å; V331-L347 HydrophobicContact CB-CD1 4.47Å; V331-L347 HydrophobicContact CG2-CD1 4.23Å; L333-L347 HydrophobicContact CD1-CD2 4.1Å
348	R	98.6	Very high	96.7	Very high	11 Å²	11	61.6 Å²	61.6	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	142.2	178.6	-174.2	-166.8	61.2	-165.8	-6.6	108.5	V29 S31 T44 A45 I217 D218 I220 L351	V29-R348 HydrophobicContact CG1-CG 4.37Å; S31-R348 WeakPolarHBondContact O-CD 3.36Å; S31-R348 PolarHBondContact O-NH1 3.45Å; T44-R348 CarbonylContact O-C 3.28Å; T44-R348 WeakPolarHBondContact O-CA 3.41Å; A45-R348 HydrophobicContact CB-CB 4.47Å; I217-R348 WeakPolarHBondContact CB-O 3.17Å; D218-R348 HydrophobicContact CB-CB 4.41Å; D218-R348 PolarHBondContact N-O 3Å; D218-R348 PolarHBondContact O-N 3.49Å; D218-R348 IonicContact OD2-CZ 2.76Å; D218-R348 IonicContact OD2-NE 2.99Å; D218-R348 PolarHBondContact OD2-NE 3.27Å; D218-R348 IonicContact OD2-NH2 3.09Å; D218-R348 PolarHBondContact OD2-NH2 2.88Å; I220-R348 HydrophobicContact CD1-CB 4.26Å; R348-L351 VanDerWaalsContact CZ-CG 3.44Å; R348-L351 VanDerWaalsContact NH2-CD1 3.32Å; R348-L351 VanDerWaalsContact NH2-CG 3.31Å
349	K	98.3	Very high	96.5	Very high	39 Å²	39	61.7 Å²	61.7	17%	0.17	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	147.7	166.9	-74.6	-168.4	174.9	-79.1	0	109.7	P33 T44 V210 F211 E215 L351	P33-K349 HydrophobicContact CG-CB 3.85Å; T44-K349 PolarHBondContact O-N 3.41Å; V210-K349 WeakPolarHBondContact O-CE 3.33Å; V210-K349 PolarHBondContact O-NZ 2.91Å; F211-K349 HydrophobicContact CD1-CG 4.05Å; F211-K349 HydrophobicContact CE1-CB 4.39Å; F211-K349 HydrophobicContact CE1-CG 3.66Å; E215-K349 IonicContact OE1-NZ 3.17Å; E215-K349 PolarHBondContact OE1-NZ 2.98Å; E215-K349 IonicContact OE2-NZ 2.89Å; E215-K349 PolarHBondContact OE2-NZ 2.67Å; E215-K349 VanDerWaalsContact OE2-NZ 3.09Å; K349-L351 PolarHBondContact O-N 2.77Å
350	S	97.4	Very high	96.5	Very high	17 Å²	17	66.4 Å²	66.4	12%	0.119	32%	0.318	C	S	.	.			trans	-57.2	138.5	-177.6	172.3	0	0	0	0	111.3	M216 L352 Q354	M216-S350 WeakPolarHBondContact O-CB 3.36Å; S350-L352 VanDerWaalsContact C-N 3.28Å; S350-L352 WeakPolarHBondContact CB-O 3.44Å; S350-L352 PolarHBondContact OG-N 3.39Å; S350-L352 PolarHBondContact OG-O 2.69Å; S350-Q354 PolarHBondContact OG-NE2 3.47Å
351	L	97	Very high	96.4	Very high	80 Å²	80	65 Å²	65	42%	0.419	31%	0.308	S	S	.	.	S	Bend	trans	-75.5	-22.1	166.9	-64	-178.1	0	0	0	112.7	F32 P33 D218 R348 K349	F32-L351 VanDerWaalsContact C-CD2 3.41Å; F32-L351 VanDerWaalsContact O-CD2 3.28Å; F32-L351 WeakPolarHBondContact O-CD2 3.43Å; P33-L351 HydrophobicContact CG-CD2 4.39Å; D218-L351 PolarHBondContact OD2-N 2.92Å; R348-L351 VanDerWaalsContact CZ-CG 3.44Å; R348-L351 VanDerWaalsContact NH2-CD1 3.32Å; R348-L351 VanDerWaalsContact NH2-CG 3.31Å; K349-L351 PolarHBondContact O-N 2.77Å
352	L	94.5	Very high	96.4	Very high	91 Å²	91	70 Å²	70	48%	0.476	33%	0.33	S	S	.	.	S	Bend	trans	-90.7	135.9	179.6	-57.6	176.2	0	0	0	109.1	I280 S350 Q354	I280-L352 HydrophobicContact CD1-CD1 4.21Å; S350-L352 VanDerWaalsContact C-N 3.28Å; S350-L352 WeakPolarHBondContact CB-O 3.44Å; S350-L352 PolarHBondContact OG-N 3.39Å; S350-L352 PolarHBondContact OG-O 2.69Å; L352-Q354 PolarHBondContact O-N 3.12Å
353	V	93.2	Very high	96.3	Very high	132 Å²	132	66.2 Å²	66.2	80%	0.8	31%	0.314	S	S	*	.			trans	-69.2	122.8	165.9	-177.5	0	0	0	0	107.7	T355	V353-T355 HydrophobicContact CG1-CG2 4.16Å; V353-T355 PolarHBondContact O-N 2.62Å
354	Q	95.1	Very high	96	Very high	44 Å²	44	68.4 Å²	68.4	21%	0.206	33%	0.327	C	S	.	.			trans	-93.4	103.7	-173	-61.2	-69.1	-18.3	0	0	110	M216 N281 S350 L352 A359	M216-Q354 HydrophobicContact CB-CG 3.92Å; M216-Q354 HydrophobicContact CG-CG 4.29Å; N281-Q354 PolarHBondContact OD1-NE2 2.86Å; S350-Q354 PolarHBondContact OG-NE2 3.47Å; L352-Q354 PolarHBondContact O-N 3.12Å; Q354-A359 HydrophobicContact CB-CB 3.93Å; Q354-A359 HydrophobicContact CG-CB 4.45Å
355	T	95	Very high	95.9	Very high	108 Å²	108	69 Å²	69	66%	0.663	33%	0.33	S	S	*	.			trans	-113.4	-12.9	179.5	55.8	0	0	0	0	113.2	V353	V353-T355 HydrophobicContact CG1-CG2 4.16Å; V353-T355 PolarHBondContact O-N 2.62Å
356	K	95	Very high	95.9	Very high	160 Å²	160	70.4 Å²	70.4	70%	0.696	34%	0.337	S	S	*	.	S	Bend	trans	-69.8	136.6	-177	-63.6	-172.9	178.5	-173.3	0	110.1	R358 A359 L360	K356-R358 PolarHBondContact O-N 3.13Å; K356-R358 VanDerWaalsContact O-N 3.11Å; K356-A359 HydrophobicContact CB-CB 4.45Å; K356-A359 WeakPolarHBondContact O-CA 3.43Å; K356-A359 VanDerWaalsContact O-CB 3.3Å; K356-A359 WeakPolarHBondContact O-CB 3.12Å; K356-A359 PolarHBondContact O-N 3.28Å; K356-L360 PolarHBondContact O-N 3.11Å; K356-L360 VanDerWaalsContact O-N 3.13Å
357	R	94	Very high	95.8	Very high	213 Å²	213	72.8 Å²	72.8	80%	0.804	35%	0.347	S	S	*	.	H	α-helix	trans	-47.8	-43.3	176.4	-68.9	-174.7	178.6	177.4	-0.8	113.2	A359 L360 E361	R357-A359 VanDerWaalsContact C-N 3.27Å; R357-A359 PolarHBondContact O-N 2.79Å; R357-L360 CarbonylContact O-C 3.58Å; R357-L360 PolarHBondContact O-N 3Å; R357-L360 VanDerWaalsContact O-N 3.12Å; R357-E361 PolarHBondContact O-N 2.85Å
358	R	93.5	Very high	95.8	Very high	147 Å²	147	72.8 Å²	72.8	56%	0.555	35%	0.347	S	S	*	.	H	α-helix	trans	-60.1	-33.3	176.1	-171	178.8	-174.5	-177.6	3.5	113.7	K283 K356	K283-R358 PolarHBondContact NZ-O 2.67Å; K356-R358 PolarHBondContact O-N 3.13Å; K356-R358 VanDerWaalsContact O-N 3.11Å
359	A	95.2	Very high	95.8	Very high	7 Å²	7	72.5 Å²	72.5	6%	0.058	35%	0.346	C	S	.	.	H	α-helix	trans	-76.7	-33.1	177	0	0	0	0	0	111.8	M216 K283 Q354 K356 R357	M216-A359 HydrophobicContact CE-CB 4.12Å; M216-A359 HydrophobicContact CG-CB 3.83Å; K283-A359 PolarHBondContact NZ-O 3.11Å; Q354-A359 HydrophobicContact CB-CB 3.93Å; Q354-A359 HydrophobicContact CG-CB 4.45Å; K356-A359 HydrophobicContact CB-CB 4.45Å; K356-A359 WeakPolarHBondContact O-CA 3.43Å; K356-A359 VanDerWaalsContact O-CB 3.3Å; K356-A359 WeakPolarHBondContact O-CB 3.12Å; K356-A359 PolarHBondContact O-N 3.28Å; R357-A359 VanDerWaalsContact C-N 3.27Å; R357-A359 PolarHBondContact O-N 2.79Å
360	L	95.5	Very high	95.7	Very high	114 Å²	114	70.7 Å²	70.7	60%	0.597	34%	0.339	S	S	*	.	H	α-helix	trans	-88.5	-10.3	179.4	-60.6	176.1	0	0	0	114.5	K356 R357 K362	K356-L360 PolarHBondContact O-N 3.11Å; K356-L360 VanDerWaalsContact O-N 3.13Å; R357-L360 CarbonylContact O-C 3.58Å; R357-L360 PolarHBondContact O-N 3Å; R357-L360 VanDerWaalsContact O-N 3.12Å; L360-K362 PolarHBondContact O-N 3.36Å
361	E	95.2	Very high	95.7	Very high	12 Å²	12	70.7 Å²	70.7	6%	0.056	34%	0.338	C	S	.	.			trans	-51	120.9	178.7	-178.5	-178.8	175.2	0	0	111.6	R58 R62 K283 R357 I363	R58-E361 IonicContact CZ-OE1 2.8Å; R58-E361 IonicContact NH1-OE1 2.65Å; R58-E361 PolarHBondContact NH1-OE1 2.87Å; R58-E361 IonicContact NH2-OE1 3.41Å; R58-E361 PolarHBondContact NH2-OE1 2.97Å; R58-E361 IonicContact NH2-OE2 2.73Å; R62-E361 IonicContact CZ-OE1 3.42Å; R62-E361 IonicContact CZ-OE2 2.77Å; R62-E361 IonicContact NE-OE1 2.69Å; R62-E361 IonicContact NE-OE2 3.94Å; R62-E361 PolarHBondContact NE-OE2 3.38Å; R62-E361 IonicContact NH2-OE1 3.64Å; R62-E361 IonicContact NH2-OE2 3.19Å; R62-E361 PolarHBondContact NH2-OE2 2.84Å; K283-E361 WeakPolarHBondContact CE-O 3.35Å; K283-E361 PolarHBondContact NZ-O 2.83Å; R357-E361 PolarHBondContact O-N 2.85Å; E361-I363 HydrophobicContact CG-CD1 4.29Å
362	K	96.1	Very high	95.8	Very high	177 Å²	177	68.1 Å²	68.1	77%	0.77	33%	0.327	S	S	*	.			trans	-69.3	140.4	172.2	-65.9	-176.2	179.4	-179.2	0	109.8	D214 L360	D214-K362 VanDerWaalsContact OD2-CA 3.29Å; D214-K362 WeakPolarHBondContact OD2-CA 3Å; L360-K362 PolarHBondContact O-N 3.36Å
363	I	96	Very high	95.9	Very high	17 Å²	17	66.7 Å²	66.7	9%	0.087	32%	0.317	C	S	.	.			trans	-105.4	114.3	-177.8	-55.8	-62.4	0	0	0	109.4	D214 K283 Y285 E361 L365	D214-I363 VanDerWaalsContact CG-N 3.3Å; D214-I363 VanDerWaalsContact OD1-CB 3.25Å; D214-I363 WeakPolarHBondContact OD1-CB 3.13Å; D214-I363 PolarHBondContact OD1-N 3.35Å; D214-I363 PolarHBondContact OD2-N 3.1Å; K283-I363 HydrophobicContact CD-CD1 4.1Å; K283-I363 HydrophobicContact CD-CG1 4.13Å; K283-I363 VanDerWaalsContact CE-CG1 3.44Å; Y285-I363 HydrophobicContact CD1-CB 4.38Å; Y285-I363 HydrophobicContact CD1-CD1 4.21Å; Y285-I363 HydrophobicContact CD1-CG1 3.77Å; Y285-I363 HydrophobicContact CD1-CG2 4.01Å; Y285-I363 HydrophobicContact CD2-CG2 4.3Å; Y285-I363 HydrophobicContact CE1-CD1 3.78Å; Y285-I363 HydrophobicContact CE1-CG1 3.85Å; Y285-I363 HydrophobicContact CE1-CG2 4.41Å; Y285-I363 HydrophobicContact CG-CG2 3.94Å; E361-I363 HydrophobicContact CG-CD1 4.29Å; I363-L365 HydrophobicContact CG2-CD2 3.74Å; I363-L365 HydrophobicContact CG2-CG 4.26Å
364	D	92.7	Very high	96	Very high	66 Å²	66	68.1 Å²	68.1	35%	0.353	31%	0.312	S	S	.	.			trans	-104.6	119.2	170	-175.5	16	0	0	0	109.6	R58 Y307	R58-D364 WeakPolarHBondContact CB-O 3.46Å; Y307-D364 VanDerWaalsContact CE2-OD2 3.31Å; Y307-D364 WeakPolarHBondContact CE2-OD2 3.31Å; Y307-D364 PolarHBondContact OH-OD2 3.11Å; Y307-D364 VanDerWaalsContact OH-OD2 3.14Å
365	L	96.6	Very high	96.1	Very high	13 Å²	13	68.9 Å²	68.9	7%	0.068	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.2	-176.8	-63.1	-178.2	0	0	0	109.3	I56 R58 Y285 K286 T305 M332 I363 I368	I56-L365 HydrophobicContact CB-CD2 4.25Å; I56-L365 HydrophobicContact CD1-CD2 3.66Å; I56-L365 HydrophobicContact CG1-CD2 4.04Å; R58-L365 HydrophobicContact CB-CD2 4.27Å; Y285-L365 HydrophobicContact CD2-CD2 4.32Å; K286-L365 HydrophobicContact CB-CD1 4Å; K286-L365 HydrophobicContact CD-CD1 4.11Å; T305-L365 WeakPolarHBondContact CB-O 3.41Å; T305-L365 HydrophobicContact CG2-CB 4.06Å; T305-L365 WeakPolarHBondContact CG2-O 3.23Å; M332-L365 HydrophobicContact CE-CD1 4.46Å; M332-L365 HydrophobicContact SD-CD1 3.98Å; I363-L365 HydrophobicContact CG2-CD2 3.74Å; I363-L365 HydrophobicContact CG2-CG 4.26Å; L365-I368 HydrophobicContact CD1-CD1 4.11Å; L365-I368 HydrophobicContact CD1-CG1 4.35Å
366	K	97.1	Very high	96.1	Very high	30 Å²	30	72.6 Å²	72.6	13%	0.13	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-38	174.5	-65.9	-166	171.8	178.3	0	112.3	V57 E59 E71 T305 Y307	V57-K366 HydrophobicContact CG1-CB 4.42Å; V57-K366 PolarHBondContact O-N 3.45Å; E59-K366 WeakPolarHBondContact OE2-CE 3.28Å; E59-K366 IonicContact OE2-NZ 2.55Å; E59-K366 PolarHBondContact OE2-NZ 2.67Å; E71-K366 HydrophobicContact CG-CD 4.02Å; E71-K366 WeakPolarHBondContact OE1-CD 3.03Å; E71-K366 IonicContact OE1-NZ 3.3Å; E71-K366 PolarHBondContact OE1-NZ 3.15Å; T305-K366 PolarHBondContact OG1-O 2.85Å; Y307-K366 HydrophobicContact CD1-CD 4.4Å; Y307-K366 HydrophobicContact CD1-CG 4.38Å; Y307-K366 HydrophobicContact CD2-CB 4.2Å; Y307-K366 HydrophobicContact CD2-CG 3.72Å; Y307-K366 HydrophobicContact CE1-CD 4.48Å; Y307-K366 HydrophobicContact CE2-CG 3.93Å; Y307-K366 HydrophobicContact CG-CB 4.27Å; Y307-K366 HydrophobicContact CG-CD 4.43Å; Y307-K366 HydrophobicContact CG-CG 3.95Å
367	F	97.4	Very high	96.1	Very high	50 Å²	50	66.3 Å²	66.3	22%	0.219	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	143.7	-176.1	178.7	-104.9	0	0	0	111.8	I56 V57 D308 D369 Q380	I56-F367 CarbonylContact C-O 3.36Å; I56-F367 WeakPolarHBondContact CA-O 3.48Å; I56-F367 VanDerWaalsContact CB-O 3.32Å; I56-F367 WeakPolarHBondContact CB-O 3.49Å; V57-F367 HydrophobicContact CB-CB 3.82Å; V57-F367 HydrophobicContact CG2-CB 3.94Å; V57-F367 HydrophobicContact CG2-CD1 4.03Å; V57-F367 HydrophobicContact CG2-CG 4.42Å; V57-F367 PolarHBondContact N-O 2.99Å; V57-F367 PolarHBondContact O-N 3.29Å; V57-F367 VanDerWaalsContact O-N 3.1Å; D308-F367 HydrophobicContact CB-CD2 4.35Å; D308-F367 WeakPolarHBondContact OD2-CD2 3.46Å; D308-F367 WeakPolarHBondContact OD2-CE2 3.3Å; F367-D369 HydrophobicContact CD1-CB 4.48Å; F367-D369 HydrophobicContact CE1-CB 3.81Å; F367-Q380 HydrophobicContact CE2-CG 4.18Å; F367-Q380 HydrophobicContact CZ-CG 3.95Å
368	I	98.1	Very high	96.2	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	121.3	171	-59.8	169.3	0	0	0	108.4	T54 I56 K286 A303 T305 K312 I314 M332 L365 T370	T54-I368 HydrophobicContact CG2-CG2 4.38Å; I56-I368 HydrophobicContact CG2-CB 4.38Å; I56-I368 HydrophobicContact CG2-CG1 3.93Å; I56-I368 HydrophobicContact CG2-CG2 4.34Å; K286-I368 HydrophobicContact CD-CD1 4.2Å; A303-I368 HydrophobicContact CB-CB 4.26Å; A303-I368 HydrophobicContact CB-CD1 4.17Å; A303-I368 HydrophobicContact CB-CG2 4.14Å; T305-I368 HydrophobicContact CG2-CD1 4.27Å; T305-I368 HydrophobicContact CG2-CG1 4.3Å; K312-I368 PolarHBondContact NZ-O 3.49Å; I314-I368 HydrophobicContact CD1-CG2 3.61Å; M332-I368 HydrophobicContact CE-CD1 3.8Å; M332-I368 HydrophobicContact CE-CG1 4.08Å; M332-I368 HydrophobicContact CE-CG2 4.1Å; L365-I368 HydrophobicContact CD1-CD1 4.11Å; L365-I368 HydrophobicContact CD1-CG1 4.35Å; I368-T370 PolarHBondContact O-N 3.06Å
369	D	98.1	Very high	96.4	Very high	5 Å²	5	60.3 Å²	60.3	3%	0.027	30%	0.3	C	S	.	.			trans	-76.3	121.9	-179.4	175.5	47.1	0	0	0	111.4	T54 H55 F367 T371 K373 Q380	T54-D369 PolarHBondContact OG1-O 3.34Å; H55-D369 VanDerWaalsContact CE1-CB 3.45Å; H55-D369 WeakPolarHBondContact CE1-CB 3.32Å; H55-D369 IonicContact CE1-OD2 3.46Å; H55-D369 PolarHBondContact CE1-OD2 3.3Å; H55-D369 IonicContact ND1-OD2 3.89Å; H55-D369 PolarHBondContact ND1-OD2 2.88Å; H55-D369 IonicContact NE2-OD2 2.9Å; H55-D369 WeakPolarHBondContact O-CB 3.39Å; H55-D369 PolarHBondContact O-N 3.01Å; F367-D369 HydrophobicContact CD1-CB 4.48Å; F367-D369 HydrophobicContact CE1-CB 3.81Å; D369-T371 VanDerWaalsContact CG-OG1 3.24Å; D369-T371 WeakPolarHBondContact OD1-CB 3.23Å; D369-T371 WeakPolarHBondContact OD1-CG2 3.49Å; D369-T371 PolarHBondContact OD1-N 3.28Å; D369-T371 PolarHBondContact OD1-OG1 3.01Å; D369-T371 PolarHBondContact OD2-OG1 3.33Å; D369-T371 VanDerWaalsContact OD2-OG1 3.04Å; D369-K373 IonicContact OD1-NZ 2.67Å; D369-K373 VanDerWaalsContact OD2-CE 3.24Å; D369-K373 WeakPolarHBondContact OD2-CE 3.43Å; D369-K373 IonicContact OD2-NZ 2.98Å; D369-K373 PolarHBondContact OD2-NZ 3.44Å; D369-Q380 PolarHBondContact OD1-NE2 2.89Å; D369-Q380 PolarHBondContact OD1-OE1 2.86Å
370	T	97.7	Very high	96.4	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.012	30%	0.304	C	S	.	.			trans	-121.7	12.5	-177.7	55	0	0	0	0	111.9	A303 K312 S313 P316 L317 I368 Q380	A303-T370 HydrophobicContact CB-CG2 4.17Å; K312-T370 HydrophobicContact CD-CG2 4.08Å; K312-T370 WeakPolarHBondContact CD-OG1 3.22Å; K312-T370 HydrophobicContact CG-CG2 4.37Å; S313-T370 WeakPolarHBondContact O-CG2 3.41Å; P316-T370 CarbonylContact C-O 3.54Å; P316-T370 WeakPolarHBondContact CA-O 3.47Å; L317-T370 PolarHBondContact N-O 3.44Å; I368-T370 PolarHBondContact O-N 3.06Å; T370-Q380 PolarHBondContact OG1-O 3Å; T370-Q380 VanDerWaalsContact OG1-O 3.05Å; T370-Q380 PolarHBondContact OG1-OE1 3.29Å
371	T	97.6	Very high	96.4	Very high	16 Å²	16	57.1 Å²	57.1	10%	0.098	28%	0.282	C	S	.	.	S	Bend	trans	-57.1	152	170	53.1	0	0	0	0	112.4	P316 D369 K373 F379	P316-T371 WeakPolarHBondContact CB-O 3.34Å; D369-T371 VanDerWaalsContact CG-OG1 3.24Å; D369-T371 WeakPolarHBondContact OD1-CB 3.23Å; D369-T371 WeakPolarHBondContact OD1-CG2 3.49Å; D369-T371 PolarHBondContact OD1-N 3.28Å; D369-T371 PolarHBondContact OD1-OG1 3.01Å; D369-T371 PolarHBondContact OD2-OG1 3.33Å; D369-T371 VanDerWaalsContact OD2-OG1 3.04Å; T371-K373 PolarHBondContact O-N 2.68Å; T371-K373 PolarHBondContact O-NZ 2.95Å; T371-K373 PolarHBondContact OG1-NZ 2.94Å; T371-F379 WeakPolarHBondContact CA-O 3.44Å; T371-F379 WeakPolarHBondContact CG2-O 3.49Å
372	S	97.6	Very high	96.4	Very high	27 Å²	27	61.2 Å²	61.2	19%	0.189	30%	0.303	C	S	.	.			trans	-52.4	128.3	173.2	174.6	0	0	0	0	111.4	L317 F374 G377	L317-S372 WeakPolarHBondContact O-CA 3.31Å; L317-S372 WeakPolarHBondContact O-CB 3.45Å; S372-F374 VanDerWaalsContact C-N 3.34Å; S372-F374 PolarHBondContact OG-N 3.17Å; S372-F374 VanDerWaalsContact OG-N 3.1Å; S372-F374 PolarHBondContact OG-O 3.23Å; S372-F374 VanDerWaalsContact OG-O 3.11Å; S372-G377 WeakPolarHBondContact O-CA 3.45Å; S372-G377 PolarHBondContact O-N 3.22Å; S372-G377 VanDerWaalsContact O-N 3.14Å
373	K	97.1	Very high	96.2	Very high	61 Å²	61	58.8 Å²	58.8	27%	0.265	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	1.2	172.7	-56.9	-62.8	175.4	-86.8	0	112.4	T54 P316 V321 D369 T371	T54-K373 WeakPolarHBondContact OG1-CE 3.45Å; P316-K373 HydrophobicContact CB-CG 4.02Å; P316-K373 HydrophobicContact CG-CG 3.79Å; V321-K373 HydrophobicContact CG2-CB 4.05Å; V321-K373 WeakPolarHBondContact CG2-O 3.45Å; D369-K373 IonicContact OD1-NZ 2.67Å; D369-K373 VanDerWaalsContact OD2-CE 3.24Å; D369-K373 WeakPolarHBondContact OD2-CE 3.43Å; D369-K373 IonicContact OD2-NZ 2.98Å; D369-K373 PolarHBondContact OD2-NZ 3.44Å; T371-K373 PolarHBondContact O-N 2.68Å; T371-K373 PolarHBondContact O-NZ 2.95Å; T371-K373 PolarHBondContact OG1-NZ 2.94Å
374	F	96.3	Very high	96.2	Very high	161 Å²	161	61.9 Å²	61.9	71%	0.706	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	92.9	171.7	-165.8	-104.1	0	0	0	108.6	V321 S372	V321-F374 HydrophobicContact CG1-CD2 3.89Å; V321-F374 HydrophobicContact CG2-CB 3.91Å; V321-F374 HydrophobicContact CG2-CD2 4.2Å; S372-F374 VanDerWaalsContact C-N 3.34Å; S372-F374 PolarHBondContact OG-N 3.17Å; S372-F374 VanDerWaalsContact OG-N 3.1Å; S372-F374 PolarHBondContact OG-O 3.23Å; S372-F374 VanDerWaalsContact OG-O 3.11Å
375	G	95.8	Very high	96.4	Very high	60 Å²	60	62.7 Å²	62.7	62%	0.619	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	93	-149.6	-168.1	0	0	0	0	0	111.9
376	H	96.2	Very high	96.3	Very high	187 Å²	187	68.7 Å²	68.7	87%	0.866	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	92.1	177.1	-61.1	-79.3	0	0	0	109.4
377	G	94.6	Very high	96.3	Very high	27 Å²	27	71.2 Å²	71.2	28%	0.278	36%	0.361	S	S	.	.			trans	-67.7	134.9	177.6	0	0	0	0	0	111.9	S372	S372-G377 WeakPolarHBondContact O-CA 3.45Å; S372-G377 PolarHBondContact O-N 3.22Å; S372-G377 VanDerWaalsContact O-N 3.14Å
378	R	96.3	Very high	96.2	Very high	207 Å²	207	76.1 Å²	76.1	78%	0.781	38%	0.382	S	S	*	.			trans	-108.4	-25.5	180	-67.6	-173.5	176.6	-177	-1.9	114.3
379	F	97	Very high	96.2	Very high	28 Å²	28	80.7 Å²	80.7	12%	0.123	40%	0.404	C	S	.	.			trans	-111.9	144.1	-175.6	-48.8	-71.9	0	0	0	109.8	L317 T371 E384 K385 F388	L317-F379 HydrophobicContact CD1-CB 4.1Å; L317-F379 VanDerWaalsContact CD1-O 3.26Å; L317-F379 WeakPolarHBondContact CD1-O 3.15Å; T371-F379 WeakPolarHBondContact CA-O 3.44Å; T371-F379 WeakPolarHBondContact CG2-O 3.49Å; F379-E384 HydrophobicContact CB-CB 4.49Å; F379-E384 HydrophobicContact CB-CG 4.38Å; F379-E384 HydrophobicContact CD1-CG 4.07Å; F379-K385 HydrophobicContact CB-CB 3.9Å; F379-K385 HydrophobicContact CD1-CB 4.47Å; F379-K385 HydrophobicContact CD2-CB 3.62Å; F379-K385 HydrophobicContact CD2-CD 4.04Å; F379-K385 HydrophobicContact CD2-CG 3.57Å; F379-K385 HydrophobicContact CE2-CB 4.29Å; F379-K385 HydrophobicContact CE2-CD 4.5Å; F379-K385 HydrophobicContact CE2-CG 3.87Å; F379-K385 HydrophobicContact CG-CB 3.73Å; F379-K385 HydrophobicContact CG-CG 4.21Å; F379-F388 HydrophobicContact CD1-CB 4.37Å; F379-F388 HydrophobicContact CE1-CB 3.55Å; F379-F388 AromaticContact CE1-CD1 3.7Å; F379-F388 HydrophobicContact CE1-CD1 3.7Å; F379-F388 HydrophobicContact CE1-CD2 4.05Å; F379-F388 HydrophobicContact CE1-CE1 4.42Å; F379-F388 AromaticContact CE1-CG 3.48Å; F379-F388 HydrophobicContact CE1-CG 3.48Å; F379-F388 VanDerWaalsContact CE1-CG 3.48Å; F379-F388 HydrophobicContact CZ-CB 3.98Å; F379-F388 AromaticContact CZ-CD1 3.4Å; F379-F388 HydrophobicContact CZ-CD1 3.4Å; F379-F388 VanDerWaalsContact CZ-CD1 3.4Å; F379-F388 HydrophobicContact CZ-CE1 4.01Å; F379-F388 AromaticContact CZ-CG 3.72Å; F379-F388 HydrophobicContact CZ-CG 3.72Å
380	Q	96.1	Very high	96	Very high	32 Å²	32	81.8 Å²	81.8	15%	0.15	42%	0.417	C	S	.	.	S	Bend	trans	-80.8	-41.3	176.4	-62.8	-59.4	-36.3	0	0	111.5	F367 D369 T370 E384	F367-Q380 HydrophobicContact CE2-CG 4.18Å; F367-Q380 HydrophobicContact CZ-CG 3.95Å; D369-Q380 PolarHBondContact OD1-NE2 2.89Å; D369-Q380 PolarHBondContact OD1-OE1 2.86Å; T370-Q380 PolarHBondContact OG1-O 3Å; T370-Q380 VanDerWaalsContact OG1-O 3.05Å; T370-Q380 PolarHBondContact OG1-OE1 3.29Å; Q380-E384 WeakPolarHBondContact CB-OE2 3.26Å; Q380-E384 PolarHBondContact N-OE2 2.92Å
381	T	95.8	Very high	95.9	Very high	21 Å²	21	86.1 Å²	86.1	13%	0.129	45%	0.446	C	S	.	.	S	Bend	trans	-120.3	164.3	-177.1	71	0	0	0	0	112.5	K312 E383 E384 K385	K312-T381 HydrophobicContact CB-CG2 4.01Å; K312-T381 HydrophobicContact CD-CG2 4.47Å; T381-E383 VanDerWaalsContact C-N 3.28Å; T381-E383 VanDerWaalsContact CB-OE2 3.32Å; T381-E383 WeakPolarHBondContact CB-OE2 3.37Å; T381-E384 PolarHBondContact N-OE2 2.85Å; T381-E384 VanDerWaalsContact OG1-CB 3.32Å; T381-E384 WeakPolarHBondContact OG1-CB 3.13Å; T381-E384 PolarHBondContact OG1-N 2.87Å; T381-E384 VanDerWaalsContact OG1-N 3.08Å; T381-K385 PolarHBondContact O-N 3.4Å
382	M	93.7	Very high	95.8	Very high	99 Å²	99	88.4 Å²	88.4	49%	0.488	46%	0.457	S	S	.	.	H	α-helix	trans	-70.1	-33.9	176.1	-79.7	-75.1	-79.4	0	0	110.3	L317 K385 K386	L317-M382 HydrophobicContact CD2-CG 3.73Å; L317-M382 HydrophobicContact CD2-SD 4.22Å; M382-K385 PolarHBondContact O-N 3.4Å; M382-K386 WeakPolarHBondContact O-CB 3.43Å; M382-K386 WeakPolarHBondContact O-CG 3.48Å; M382-K386 PolarHBondContact O-N 2.91Å
383	E	93.5	Very high	95.7	Very high	125 Å²	125	95.3 Å²	95.3	58%	0.584	48%	0.483	S	S	*	.	H	α-helix	trans	-64.3	-49.4	178.6	-63.2	66.9	-144.4	0	0	110	T381 K385 K386 A387	T381-E383 VanDerWaalsContact C-N 3.28Å; T381-E383 VanDerWaalsContact CB-OE2 3.32Å; T381-E383 WeakPolarHBondContact CB-OE2 3.37Å; E383-K385 VanDerWaalsContact C-N 3.31Å; E383-K385 PolarHBondContact O-N 3.46Å; E383-K386 PolarHBondContact O-N 3.11Å; E383-A387 WeakPolarHBondContact O-CB 3.5Å; E383-A387 PolarHBondContact O-N 3.14Å
384	E	95.6	Very high	95.6	Very high	82 Å²	82	99 Å²	99	38%	0.383	50%	0.499	S	S	.	.	H	α-helix	trans	-57.3	-44.7	174.4	-174.7	-163.7	156.4	0	0	111.2	F379 Q380 T381 A387 F388	F379-E384 HydrophobicContact CB-CB 4.49Å; F379-E384 HydrophobicContact CB-CG 4.38Å; F379-E384 HydrophobicContact CD1-CG 4.07Å; Q380-E384 WeakPolarHBondContact CB-OE2 3.26Å; Q380-E384 PolarHBondContact N-OE2 2.92Å; T381-E384 PolarHBondContact N-OE2 2.85Å; T381-E384 VanDerWaalsContact OG1-CB 3.32Å; T381-E384 WeakPolarHBondContact OG1-CB 3.13Å; T381-E384 PolarHBondContact OG1-N 2.87Å; T381-E384 VanDerWaalsContact OG1-N 3.08Å; E384-A387 PolarHBondContact O-N 3.45Å; E384-F388 WeakPolarHBondContact O-CB 3.33Å; E384-F388 PolarHBondContact O-N 3.16Å
385	K	96.2	Very high	95.5	Very high	84 Å²	84	94.6 Å²	94.6	37%	0.365	48%	0.483	S	S	.	.	H	α-helix	trans	-62.4	-45	177.1	179.6	176.8	178.2	-177.1	0	112.4	F379 T381 M382 E383 F388 M389	F379-K385 HydrophobicContact CB-CB 3.9Å; F379-K385 HydrophobicContact CD1-CB 4.47Å; F379-K385 HydrophobicContact CD2-CB 3.62Å; F379-K385 HydrophobicContact CD2-CD 4.04Å; F379-K385 HydrophobicContact CD2-CG 3.57Å; F379-K385 HydrophobicContact CE2-CB 4.29Å; F379-K385 HydrophobicContact CE2-CD 4.5Å; F379-K385 HydrophobicContact CE2-CG 3.87Å; F379-K385 HydrophobicContact CG-CB 3.73Å; F379-K385 HydrophobicContact CG-CG 4.21Å; T381-K385 PolarHBondContact O-N 3.4Å; M382-K385 PolarHBondContact O-N 3.4Å; E383-K385 VanDerWaalsContact C-N 3.31Å; E383-K385 PolarHBondContact O-N 3.46Å; K385-F388 PolarHBondContact O-N 2.83Å; K385-M389 HydrophobicContact CD-SD 4.41Å; K385-M389 VanDerWaalsContact CE-SD 3.51Å; K385-M389 HydrophobicContact CG-CG 4.4Å; K385-M389 HydrophobicContact CG-SD 3.93Å; K385-M389 WeakPolarHBondContact O-CB 3.05Å; K385-M389 WeakPolarHBondContact O-CG 3.36Å; K385-M389 PolarHBondContact O-N 3.38Å
386	K	95.2	Very high	95.3	Very high	139 Å²	139	99.2 Å²	99.2	60%	0.604	48%	0.482	S	S	*	.	H	α-helix	trans	-64.8	-43.6	179.2	-77.6	178.1	178.1	-177.2	0	111	M382 E383 F388 M389 G390	M382-K386 WeakPolarHBondContact O-CB 3.43Å; M382-K386 WeakPolarHBondContact O-CG 3.48Å; M382-K386 PolarHBondContact O-N 2.91Å; E383-K386 PolarHBondContact O-N 3.11Å; K386-F388 PolarHBondContact O-N 3.47Å; K386-M389 PolarHBondContact O-N 3.28Å; K386-G390 PolarHBondContact O-N 2.84Å
387	A	95.9	Very high	95.2	Very high	83 Å²	83	93.4 Å²	93.4	69%	0.686	46%	0.457	S	S	*	.	H	α-helix	trans	-60.7	-44.8	176.9	0	0	0	0	0	111.6	E383 E384	E383-A387 WeakPolarHBondContact O-CB 3.5Å; E383-A387 PolarHBondContact O-N 3.14Å; E384-A387 PolarHBondContact O-N 3.45Å
388	F	96.6	Very high	95.1	Very high	153 Å²	153	94.9 Å²	94.9	67%	0.671	47%	0.466	S	S	*	.	H	α-helix	trans	-67.6	-42.7	178.4	-176.4	-87.4	0	0	0	113.3	F379 E384 K385 K386	F379-F388 HydrophobicContact CD1-CB 4.37Å; F379-F388 HydrophobicContact CE1-CB 3.55Å; F379-F388 AromaticContact CE1-CD1 3.7Å; F379-F388 HydrophobicContact CE1-CD1 3.7Å; F379-F388 HydrophobicContact CE1-CD2 4.05Å; F379-F388 HydrophobicContact CE1-CE1 4.42Å; F379-F388 AromaticContact CE1-CG 3.48Å; F379-F388 HydrophobicContact CE1-CG 3.48Å; F379-F388 VanDerWaalsContact CE1-CG 3.48Å; F379-F388 HydrophobicContact CZ-CB 3.98Å; F379-F388 AromaticContact CZ-CD1 3.4Å; F379-F388 HydrophobicContact CZ-CD1 3.4Å; F379-F388 VanDerWaalsContact CZ-CD1 3.4Å; F379-F388 HydrophobicContact CZ-CE1 4.01Å; F379-F388 AromaticContact CZ-CG 3.72Å; F379-F388 HydrophobicContact CZ-CG 3.72Å; E384-F388 WeakPolarHBondContact O-CB 3.33Å; E384-F388 PolarHBondContact O-N 3.16Å; K385-F388 PolarHBondContact O-N 2.83Å; K386-F388 PolarHBondContact O-N 3.47Å
389	M	96.4	Very high	94.9	Very high	95 Å²	95	92.9 Å²	92.9	47%	0.468	46%	0.463	S	S	.	.	H	α-helix	trans	-78.2	-20.8	-176.3	-71	-171.9	132.3	0	0	113.6	K385 K386 L392	K385-M389 HydrophobicContact CD-SD 4.41Å; K385-M389 VanDerWaalsContact CE-SD 3.51Å; K385-M389 HydrophobicContact CG-CG 4.4Å; K385-M389 HydrophobicContact CG-SD 3.93Å; K385-M389 WeakPolarHBondContact O-CB 3.05Å; K385-M389 WeakPolarHBondContact O-CG 3.36Å; K385-M389 PolarHBondContact O-N 3.38Å; K386-M389 PolarHBondContact O-N 3.28Å; M389-L392 HydrophobicContact CB-CD2 4.37Å; M389-L392 HydrophobicContact SD-CD1 4.34Å
390	G	95.3	Very high	94.7	Very high	29 Å²	29	98.2 Å²	98.2	30%	0.299	49%	0.489	S	S	.	.			trans	65.5	-172.3	-171.7	0	0	0	0	0	113.1	K386 L392	K386-G390 PolarHBondContact O-N 2.84Å; G390-L392 PolarHBondContact O-N 2.9Å
391	P	94.1	Very high	94.5	Very high	93 Å²	93	104.2 Å²	104.2	60%	0.604	52%	0.517	S	S	*	.	S	Bend	trans	-70.4	113.4	178.2	27.7	-33	0	0	0	110.8
392	L	95.7	Very high	93.9	Very high	64 Å²	64	106.6 Å²	106.6	34%	0.335	55%	0.546	S	S	.	.			trans	-83.9	167.3	176.6	-58.8	175.1	0	0	0	110.9	M389 G390 K394 D395 R396	M389-L392 HydrophobicContact CB-CD2 4.37Å; M389-L392 HydrophobicContact SD-CD1 4.34Å; G390-L392 PolarHBondContact O-N 2.9Å; L392-K394 VanDerWaalsContact C-N 3.27Å; L392-K394 HydrophobicContact CB-CG 4.2Å; L392-K394 PolarHBondContact O-N 3.2Å; L392-D395 WeakPolarHBondContact CB-OD2 3.3Å; L392-D395 PolarHBondContact N-OD2 3.47Å; L392-D395 WeakPolarHBondContact O-CB 3.5Å; L392-D395 PolarHBondContact O-N 2.99Å; L392-R396 PolarHBondContact O-N 3.42Å; L392-R396 VanDerWaalsContact O-N 3.11Å
393	K	96.4	Very high	92.6	Very high	171 Å²	171	108.3 Å²	108.3	74%	0.743	58%	0.575	S	S	*	*	H	α-helix	trans	-49.9	-46.5	177.6	-176.3	176.3	-179.2	177	0	112.8	D395 R396 I397	K393-D395 VanDerWaalsContact C-N 3.27Å; K393-D395 PolarHBondContact O-N 3.3Å; K393-R396 PolarHBondContact O-N 3.04Å; K393-I397 HydrophobicContact CG-CD1 3.94Å; K393-I397 WeakPolarHBondContact O-CG1 3.37Å; K393-I397 PolarHBondContact O-N 3.11Å
394	K	95.2	Very high	92.6	Very high	139 Å²	139	107.5 Å²	107.5	60%	0.604	58%	0.575	S	S	*	*	H	α-helix	trans	-62.9	-30.9	178.2	62.8	174.5	-173.5	168.9	0	113.7	L392 A398	L392-K394 VanDerWaalsContact C-N 3.27Å; L392-K394 HydrophobicContact CB-CG 4.2Å; L392-K394 PolarHBondContact O-N 3.2Å; K394-A398 WeakPolarHBondContact O-CB 3.45Å; K394-A398 PolarHBondContact O-N 3.29Å
395	D	93.1	Very high	92.4	Very high	69 Å²	69	108.8 Å²	108.8	37%	0.369	59%	0.585	S	S	.	*	H	α-helix	trans	-78.4	-32.6	-178.4	-52.2	-43.2	0	0	0	109.7	L392 K393 K399	L392-D395 WeakPolarHBondContact CB-OD2 3.3Å; L392-D395 PolarHBondContact N-OD2 3.47Å; L392-D395 WeakPolarHBondContact O-CB 3.5Å; L392-D395 PolarHBondContact O-N 2.99Å; K393-D395 VanDerWaalsContact C-N 3.27Å; K393-D395 PolarHBondContact O-N 3.3Å; D395-K399 WeakPolarHBondContact O-CB 3.26Å; D395-K399 PolarHBondContact O-N 2.84Å; D395-K399 VanDerWaalsContact O-N 3.13Å
396	R	91.8	Very high	92.2	Very high	156 Å²	156	110.2 Å²	110.2	59%	0.589	60%	0.597	S	S	*	*	H	α-helix	trans	-66.5	-48.1	170.7	-62.3	-176	-174.5	-168.6	-1.4	111.6	L392 K393 A398 K399 E400	L392-R396 PolarHBondContact O-N 3.42Å; L392-R396 VanDerWaalsContact O-N 3.11Å; K393-R396 PolarHBondContact O-N 3.04Å; R396-A398 PolarHBondContact O-N 2.93Å; R396-K399 WeakPolarHBondContact O-CB 3.23Å; R396-K399 PolarHBondContact O-N 2.59Å; R396-E400 WeakPolarHBondContact O-CG 3.33Å; R396-E400 PolarHBondContact O-N 2.79Å
397	I	94.8	Very high	92	Very high	65 Å²	65	108.5 Å²	108.5	33%	0.333	60%	0.596	S	S	.	*	H	α-helix	trans	-58.4	-46.5	176.1	-65.9	166.3	0	0	0	110.7	K393 K399 E400 E401	K393-I397 HydrophobicContact CG-CD1 3.94Å; K393-I397 WeakPolarHBondContact O-CG1 3.37Å; K393-I397 PolarHBondContact O-N 3.11Å; I397-K399 PolarHBondContact O-N 3.17Å; I397-E400 PolarHBondContact O-N 2.8Å; I397-E400 VanDerWaalsContact O-N 3.1Å; I397-E401 HydrophobicContact CG2-CG 4.26Å; I397-E401 WeakPolarHBondContact O-CG 3.14Å; I397-E401 PolarHBondContact O-N 3.28Å
398	A	93.1	Very high	91.8	Very high	59 Å²	59	110.1 Å²	110.1	49%	0.488	59%	0.591	S	S	.	*	H	α-helix	trans	-63.8	-27.3	177.6	0	0	0	0	0	113.5	K394 R396 G402	K394-A398 WeakPolarHBondContact O-CB 3.45Å; K394-A398 PolarHBondContact O-N 3.29Å; R396-A398 PolarHBondContact O-N 2.93Å; A398-G402 PolarHBondContact O-N 3.11Å; A398-G402 VanDerWaalsContact O-N 3.16Å
399	K	92	Very high	91.4	Very high	165 Å²	165	107.2 Å²	107.2	72%	0.717	59%	0.585	S	S	*	*	H	α-helix	trans	-76.3	-35.7	173.9	-171	-178.6	178.3	-174.1	0	111.7	D395 R396 I397 A403	D395-K399 WeakPolarHBondContact O-CB 3.26Å; D395-K399 PolarHBondContact O-N 2.84Å; D395-K399 VanDerWaalsContact O-N 3.13Å; R396-K399 WeakPolarHBondContact O-CB 3.23Å; R396-K399 PolarHBondContact O-N 2.59Å; I397-K399 PolarHBondContact O-N 3.17Å; K399-A403 VanDerWaalsContact O-CB 3.31Å; K399-A403 WeakPolarHBondContact O-CB 3.29Å; K399-A403 PolarHBondContact O-N 3.19Å
400	E	92	Very high	91.1	Very high	140 Å²	140	108.1 Å²	108.1	65%	0.654	59%	0.594	S	S	*	*	H	α-helix	trans	-71.2	-35.4	175	-70.9	164.6	-167	0	0	112.1	R396 I397	R396-E400 WeakPolarHBondContact O-CG 3.33Å; R396-E400 PolarHBondContact O-N 2.79Å; I397-E400 PolarHBondContact O-N 2.8Å; I397-E400 VanDerWaalsContact O-N 3.1Å
401	E	91.5	Very high	90.8	Very high	158 Å²	158	114.2 Å²	114.2	74%	0.738	62%	0.617	S	S	*	*	H	α-helix	trans	-80.7	-23.2	177.4	-70.2	176.2	172.2	0	0	113.8	I397	I397-E401 HydrophobicContact CG2-CG 4.26Å; I397-E401 WeakPolarHBondContact O-CG 3.14Å; I397-E401 PolarHBondContact O-N 3.28Å
402	G	84.6	Confident	90.5	Very high	71 Å²	71	115.9 Å²	115.9	73%	0.732	62%	0.618	S	S	*	*	H	α-helix	trans	-97.2	-7	-179.7	0	0	0	0	0	114.7	A398	A398-G402 PolarHBondContact O-N 3.11Å; A398-G402 VanDerWaalsContact O-N 3.16Å
403	A	65.6	Low	90	Very high	134 Å²	134	120.6 Å²	120.6	100%	1.107	64%	0.643	S	S	*	*			trans	-92	0	168.1	0	0	0	0	0	108.9	K399	K399-A403 VanDerWaalsContact O-CB 3.31Å; K399-A403 WeakPolarHBondContact O-CB 3.29Å; K399-A403 PolarHBondContact O-N 3.19Å

Retrieved 403 of 403 residues in 165.7 ms (Link to these results)

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