A0A060XYS6_ONCMY Loading...

Large ribosomal subunit protein uL2

Component of the large ribosomal subunit. The ribosome is a large ribonucleoprotein complex responsible for the synthesis of proteins in the cell.

AlphaFold DB (B5DGW7), UniProt , Accession A0A060XYS6, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene rpl8, Length 257 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	58.2	Low	92.3	Very high	238 Å²	238	94.9 Å²	94.9	100%	1.172	53%	0.526	S	S	*	.				0	130.8	0	-167.3	176.2	-88	0	0	109
2	G	88.3	Confident	92.6	Very high	65 Å²	65	94.3 Å²	94.3	67%	0.67	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-94.3	162.7	-175.7	0	0	0	0	0	113.8
3	R	96	Very high	92.5	Very high	167 Å²	167	88.7 Å²	88.7	63%	0.63	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-93.4	154.5	172.4	-77.5	173.2	175.6	176.8	-5.4	111.4	I5 V207 E208	R3-I5 PolarHBondContact O-N 3.41Å; R3-V207 HydrophobicContact CB-CG2 3.99Å; R3-V207 WeakPolarHBondContact CB-O 3.43Å; R3-V207 HydrophobicContact CG-CG2 3.73Å; R3-V207 PolarHBondContact N-O 3.01Å; R3-E208 IonicContact NH1-OE1 3.22Å; R3-E208 PolarHBondContact NH1-OE1 2.81Å
4	V	96.9	Very high	92.8	Very high	90 Å²	90	87.9 Å²	87.9	55%	0.545	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-69.1	123.4	175.3	-179.5	0	0	0	0	110.7	Q8 R9	V4-Q8 HydrophobicContact CG1-CB 3.58Å; V4-Q8 HydrophobicContact CG1-CG 4.49Å; V4-R9 HydrophobicContact CB-CG 4.46Å; V4-R9 HydrophobicContact CG1-CG 3.89Å
5	I	97.2	Very high	93.1	Very high	17 Å²	17	88.2 Å²	88.2	9%	0.087	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-73.1	156.7	-173.1	73.8	166.9	0	0	0	112.3	R3 G7 Q8 R9 E208 V235	R3-I5 PolarHBondContact O-N 3.41Å; I5-G7 PolarHBondContact O-N 2.93Å; I5-Q8 HydrophobicContact CG1-CB 4.37Å; I5-Q8 HydrophobicContact CG1-CG 4.01Å; I5-Q8 PolarHBondContact O-N 3.41Å; I5-R9 PolarHBondContact O-N 2.85Å; I5-E208 VanDerWaalsContact CG2-O 3.26Å; I5-E208 WeakPolarHBondContact CG2-O 3.17Å; I5-V235 HydrophobicContact CD1-CG1 3.41Å; I5-V235 VanDerWaalsContact CD1-CG1 3.41Å
6	R	96.3	Very high	93.4	Very high	67 Å²	67	84.6 Å²	84.6	25%	0.253	50%	0.498	S	S	.	.	H	α-helix	trans	-50.5	-36.8	178.8	-176.4	-177	65.7	-161.1	-10	113.9	K10 V199	R6-K10 WeakPolarHBondContact O-CG 3.42Å; R6-K10 PolarHBondContact O-N 2.64Å; R6-V199 PolarHBondContact NH1-O 2.77Å; R6-V199 PolarHBondContact NH2-O 3.48Å; R6-V199 VanDerWaalsContact NH2-O 3.16Å
7	G	95.8	Very high	93.6	Very high	51 Å²	51	88.1 Å²	88.1	53%	0.526	51%	0.505	S	S	.	.	H	α-helix	trans	-60.6	-45.7	178.7	0	0	0	0	0	112.6	I5	I5-G7 PolarHBondContact O-N 2.93Å
8	Q	97.2	Very high	93.9	Very high	74 Å²	74	86 Å²	86	35%	0.346	50%	0.5	S	S	.	.	H	α-helix	trans	-68	-44.6	178.8	-71.2	173.3	-65.9	0	0	111.5	V4 I5 K10 G11 A231	V4-Q8 HydrophobicContact CG1-CB 3.58Å; V4-Q8 HydrophobicContact CG1-CG 4.49Å; I5-Q8 HydrophobicContact CG1-CB 4.37Å; I5-Q8 HydrophobicContact CG1-CG 4.01Å; I5-Q8 PolarHBondContact O-N 3.41Å; Q8-K10 PolarHBondContact O-N 3.2Å; Q8-G11 PolarHBondContact O-N 2.82Å; Q8-A231 HydrophobicContact CG-CB 4.16Å; Q8-A231 VanDerWaalsContact NE2-C 3.29Å; Q8-A231 PolarHBondContact NE2-O 3.02Å
9	R	97.1	Very high	94.1	Very high	134 Å²	134	86 Å²	86	51%	0.506	50%	0.495	S	S	.	.	H	α-helix	trans	-58.8	-23.6	-179.1	-58.4	-172.7	-24.8	-160.5	9.7	114	V4 I5 G11 F16	V4-R9 HydrophobicContact CB-CG 4.46Å; V4-R9 HydrophobicContact CG1-CG 3.89Å; I5-R9 PolarHBondContact O-N 2.85Å; R9-G11 VanDerWaalsContact C-N 3.27Å; R9-G11 PolarHBondContact O-N 2.7Å; R9-F16 HydrophobicContact CB-CE2 4.09Å; R9-F16 WeakPolarHBondContact O-CD2 3.41Å
10	K	97	Very high	94.3	Very high	68 Å²	68	86.1 Å²	86.1	30%	0.296	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-28.8	176.3	-74.2	178.5	179	-175.7	0	113.1	R6 Q8 G13 F16	R6-K10 WeakPolarHBondContact O-CG 3.42Å; R6-K10 PolarHBondContact O-N 2.64Å; Q8-K10 PolarHBondContact O-N 3.2Å; K10-G13 PolarHBondContact O-N 2.82Å; K10-F16 HydrophobicContact CB-CD2 4.42Å; K10-F16 HydrophobicContact CB-CG 4.35Å; K10-F16 HydrophobicContact CG-CB 4.38Å; K10-F16 HydrophobicContact CG-CD1 3.85Å; K10-F16 HydrophobicContact CG-CD2 4.04Å; K10-F16 HydrophobicContact CG-CE1 4.1Å; K10-F16 HydrophobicContact CG-CE2 4.26Å; K10-F16 HydrophobicContact CG-CG 3.82Å; K10-F16 HydrophobicContact CG-CZ 4.29Å
11	G	95.7	Very high	94.5	Very high	73 Å²	73	90.7 Å²	90.7	75%	0.753	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-33.3	-179.5	0	0	0	0	0	113.4	Q8 R9 G13	Q8-G11 PolarHBondContact O-N 2.82Å; R9-G11 VanDerWaalsContact C-N 3.27Å; R9-G11 PolarHBondContact O-N 2.7Å; G11-G13 PolarHBondContact O-N 3.3Å; G11-G13 VanDerWaalsContact O-N 3.13Å
12	A	95.9	Very high	96.4	Very high	88 Å²	88	86 Å²	86	73%	0.727	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-18	177.3	0	0	0	0	0	113.3	S14	A12-S14 PolarHBondContact O-N 3.49Å
13	G	91.3	Very high	96.8	Very high	21 Å²	21	87.3 Å²	87.3	22%	0.216	47%	0.47	C	S	.	.			trans	62.9	40	170.7	0	0	0	0	0	114.2	K10 G11 K17	K10-G13 PolarHBondContact O-N 2.82Å; G11-G13 PolarHBondContact O-N 3.3Å; G11-G13 VanDerWaalsContact O-N 3.13Å; G13-K17 WeakPolarHBondContact O-CD 3.3Å; G13-K17 WeakPolarHBondContact O-CE 3.37Å; G13-K17 WeakPolarHBondContact O-CG 3.49Å
14	S	96.3	Very high	96.9	Very high	78 Å²	78	84.9 Å²	84.9	55%	0.545	46%	0.464	S	S	.	.	S	Bend	trans	-83.8	-104.5	172.2	57	0	0	0	0	111	A12 F16 K17	A12-S14 PolarHBondContact O-N 3.49Å; S14-F16 PolarHBondContact O-N 2.77Å; S14-K17 WeakPolarHBondContact O-CG 3.35Å; S14-K17 PolarHBondContact O-N 3.2Å
15	V	97.1	Very high	96.9	Very high	92 Å²	92	82.2 Å²	82.2	56%	0.558	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-7.2	175.1	-58.8	0	0	0	0	113.5	N194	V15-N194 WeakPolarHBondContact O-CB 3.4Å
16	F	97.7	Very high	96.9	Very high	30 Å²	30	84.6 Å²	84.6	13%	0.132	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	1	-177.7	-61.5	-64.4	0	0	0	114.2	R9 K10 S14 N194	R9-F16 HydrophobicContact CB-CE2 4.09Å; R9-F16 WeakPolarHBondContact O-CD2 3.41Å; K10-F16 HydrophobicContact CB-CD2 4.42Å; K10-F16 HydrophobicContact CB-CG 4.35Å; K10-F16 HydrophobicContact CG-CB 4.38Å; K10-F16 HydrophobicContact CG-CD1 3.85Å; K10-F16 HydrophobicContact CG-CD2 4.04Å; K10-F16 HydrophobicContact CG-CE1 4.1Å; K10-F16 HydrophobicContact CG-CE2 4.26Å; K10-F16 HydrophobicContact CG-CG 3.82Å; K10-F16 HydrophobicContact CG-CZ 4.29Å; S14-F16 PolarHBondContact O-N 2.77Å; F16-N194 VanDerWaalsContact CD1-O 3.28Å; F16-N194 WeakPolarHBondContact CD1-O 3.25Å
17	K	98	Very high	97	Very high	145 Å²	145	81.6 Å²	81.6	63%	0.63	47%	0.467	S	S	*	.	S	Bend	trans	-57.6	156	174	-67.3	-174.3	-172	-176	0	111	G13 S14 R193	G13-K17 WeakPolarHBondContact O-CD 3.3Å; G13-K17 WeakPolarHBondContact O-CE 3.37Å; G13-K17 WeakPolarHBondContact O-CG 3.49Å; S14-K17 WeakPolarHBondContact O-CG 3.35Å; S14-K17 PolarHBondContact O-N 3.2Å; K17-R193 WeakPolarHBondContact O-CB 3.37Å
18	A	98.1	Very high	97.1	Very high	50 Å²	50	83 Å²	83	41%	0.413	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-65	136.3	171.9	0	0	0	0	0	110.3	V20	A18-V20 HydrophobicContact CB-CG1 3.83Å; A18-V20 PolarHBondContact O-N 3.22Å
19	H	98.3	Very high	97.1	Very high	86 Å²	86	79.5 Å²	79.5	40%	0.398	44%	0.442	S	S	.	.			trans	-77.8	105.4	170.4	-59.3	173.7	0	0	0	107.9	K190 K192	H19-K190 PolarHBondContact ND1-O 2.82Å; H19-K192 PolarHBondContact N-O 3.43Å
20	V	98.1	Very high	97.1	Very high	87 Å²	87	74 Å²	74	53%	0.527	42%	0.421	S	S	.	.			trans	-115.2	-4.9	-172	-62.9	0	0	0	0	114.4	A18 H22 R23	A18-V20 HydrophobicContact CB-CG1 3.83Å; A18-V20 PolarHBondContact O-N 3.22Å; V20-H22 VanDerWaalsContact C-N 3.3Å; V20-H22 PolarHBondContact O-N 3.37Å; V20-H22 VanDerWaalsContact O-N 3.15Å; V20-R23 WeakPolarHBondContact O-CB 3.32Å; V20-R23 PolarHBondContact O-N 3.04Å
21	K	97.9	Very high	97	Very high	184 Å²	184	76 Å²	76	80%	0.8	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-40.2	-173.3	179.4	58.7	175.2	163.8	0	114.4
22	H	97.9	Very high	97	Very high	138 Å²	138	74.2 Å²	74.2	64%	0.639	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	3	-178.2	-59	-65.9	0	0	0	114.2	V20 P52	V20-H22 VanDerWaalsContact C-N 3.3Å; V20-H22 PolarHBondContact O-N 3.37Å; V20-H22 VanDerWaalsContact O-N 3.15Å; H22-P52 HydrophobicContact CB-CB 4.47Å; H22-P52 HydrophobicContact CB-CG 4.06Å; H22-P52 WeakPolarHBondContact O-CD 3.41Å; H22-P52 WeakPolarHBondContact O-CG 3.25Å
23	R	98.1	Very high	97	Very high	93 Å²	93	71 Å²	71	35%	0.351	38%	0.375	S	S	.	.			trans	-67.7	144.4	177.3	-71.2	-167.5	-176.8	-179.3	4	110.3	V20 D51	V20-R23 WeakPolarHBondContact O-CB 3.32Å; V20-R23 PolarHBondContact O-N 3.04Å; R23-D51 VanDerWaalsContact CA-OD1 3.31Å; R23-D51 WeakPolarHBondContact CA-OD1 3.49Å; R23-D51 WeakPolarHBondContact CB-OD1 3.5Å
24	K	97.9	Very high	97.2	Very high	116 Å²	116	76.3 Å²	76.3	50%	0.504	39%	0.393	S	S	.	.			trans	-82.9	-16.4	-171.4	-55.3	-56	-177.3	-177.2	0	113.5	I49 D51 L58 L75	K24-I49 HydrophobicContact CB-CD1 3.68Å; K24-I49 HydrophobicContact CG-CD1 3.75Å; K24-I49 HydrophobicContact CG-CG1 4.45Å; K24-D51 HydrophobicContact CG-CB 4.49Å; K24-D51 PolarHBondContact N-OD1 3.4Å; K24-L58 HydrophobicContact CB-CD1 4.47Å; K24-L75 WeakPolarHBondContact O-CD1 3.28Å
25	G	96.4	Very high	97.2	Very high	34 Å²	34	73.8 Å²	73.8	35%	0.351	38%	0.376	S	S	.	.			trans	143.7	177.3	176.8	0	0	0	0	0	111.7	A27	G25-A27 PolarHBondContact O-N 3.3Å
26	A	97.3	Very high	97.1	Very high	68 Å²	68	69.6 Å²	69.6	56%	0.562	35%	0.351	S	S	*	.			trans	-76.8	107.3	175.2	0	0	0	0	0	109.4	K28	A26-K28 HydrophobicContact CB-CD 4.41Å; A26-K28 HydrophobicContact CB-CG 4.4Å; A26-K28 PolarHBondContact O-N 3.37Å
27	A	97.8	Very high	96.9	Very high	3 Å²	3	75.2 Å²	75.2	3%	0.025	37%	0.371	C	S	.	.			trans	-62.6	126.6	170.6	0	0	0	0	0	109.6	G25 L58 L75 I77 R128	G25-A27 PolarHBondContact O-N 3.3Å; A27-L58 HydrophobicContact CB-CD1 4.25Å; A27-L58 HydrophobicContact CB-CD2 3.5Å; A27-L75 CarbonylContact C-O 3.59Å; A27-L75 WeakPolarHBondContact CA-O 2.74Å; A27-I77 HydrophobicContact CB-CG1 3.85Å; A27-R128 VanDerWaalsContact C-NH2 3.33Å; A27-R128 PolarHBondContact O-NH1 2.85Å; A27-R128 PolarHBondContact O-NH2 3.11Å
28	K	97.6	Very high	96.9	Very high	82 Å²	82	73.4 Å²	73.4	36%	0.357	37%	0.365	S	S	.	.			trans	-156.3	150.6	-175.9	-69.2	-176.6	-175	174	0	108.6	A26 L75 F76 R123	A26-K28 HydrophobicContact CB-CD 4.41Å; A26-K28 HydrophobicContact CB-CG 4.4Å; A26-K28 PolarHBondContact O-N 3.37Å; K28-L75 PolarHBondContact N-O 3.37Å; K28-L75 VanDerWaalsContact O-O 3.13Å; K28-F76 WeakPolarHBondContact O-CD1 3.05Å; K28-F76 WeakPolarHBondContact O-CE1 3.14Å; K28-R123 WeakPolarHBondContact CA-O 3.47Å; K28-R123 HydrophobicContact CB-CB 3.93Å; K28-R123 HydrophobicContact CD-CB 4.46Å; K28-R123 HydrophobicContact CG-CB 4.43Å
29	L	97.6	Very high	96.8	Very high	0 Å²	0	72 Å²	72	0%	0	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-63.9	168	166.7	-58	-179.1	0	0	0	110.2	V101 C115 E117 R123 R163 V165	L29-V101 HydrophobicContact CD1-CG1 4.14Å; L29-V101 HydrophobicContact CD2-CG1 4.44Å; L29-V101 HydrophobicContact CD2-CG2 4.2Å; L29-C115 HydrophobicContact CD2-CB 4.29Å; L29-E117 HydrophobicContact CD1-CG 4.04Å; L29-R123 HydrophobicContact CB-CB 4.42Å; L29-R123 PolarHBondContact N-O 3.4Å; L29-R123 PolarHBondContact O-NE 3.13Å; L29-R123 PolarHBondContact O-NH2 2.85Å; L29-R163 HydrophobicContact CD1-CB 4.31Å; L29-V165 HydrophobicContact CD2-CG2 3.66Å
30	R	96.8	Very high	96.8	Very high	17 Å²	17	74.1 Å²	74.1	6%	0.064	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-62.9	152.6	174.6	-168.9	176.4	169.3	-81.5	0	111.4	D33 E36 E74 F76 R163	R30-D33 IonicContact CZ-OD1 3.99Å; R30-D33 IonicContact CZ-OD2 2.76Å; R30-D33 IonicContact NH1-OD1 3.41Å; R30-D33 PolarHBondContact NH1-OD1 2.95Å; R30-D33 IonicContact NH1-OD2 3.67Å; R30-D33 PolarHBondContact NH1-OD2 3.3Å; R30-D33 IonicContact NH2-OD1 2.72Å; R30-D33 IonicContact NH2-OD2 2.77Å; R30-D33 PolarHBondContact NH2-OD2 2.76Å; R30-E36 IonicContact NH1-OE2 3.34Å; R30-E36 PolarHBondContact NH1-OE2 2.95Å; R30-E74 HydrophobicContact CG-CG 4.5Å; R30-F76 HydrophobicContact CB-CE1 4.42Å; R30-F76 HydrophobicContact CB-CZ 4.16Å; R30-R163 PolarHBondContact O-NH1 3.38Å; R30-R163 VanDerWaalsContact O-NH1 3.13Å; R30-R163 PolarHBondContact O-NH2 3.4Å
31	H	95.6	Very high	96.7	Very high	112 Å²	112	70.9 Å²	70.9	52%	0.519	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-61.4	138	169.8	-176.1	-86.4	0	0	0	110.6	D33	H31-D33 PolarHBondContact O-N 3.2Å
32	I	95.1	Very high	96.7	Very high	35 Å²	35	68 Å²	68	18%	0.179	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-74.1	126	178.4	-165.8	169.2	0	0	0	110.3	R37	I32-R37 HydrophobicContact CD1-CG 4.01Å; I32-R37 HydrophobicContact CG1-CG 3.87Å
33	D	95.9	Very high	96.7	Very high	20 Å²	20	61.6 Å²	61.6	11%	0.107	30%	0.298	C	S	.	.			trans	-140.4	-173.8	178.9	68.4	-6.3	0	0	0	111.4	R30 H31 A35 E36 R37 P66	R30-D33 IonicContact CZ-OD1 3.99Å; R30-D33 IonicContact CZ-OD2 2.76Å; R30-D33 IonicContact NH1-OD1 3.41Å; R30-D33 PolarHBondContact NH1-OD1 2.95Å; R30-D33 IonicContact NH1-OD2 3.67Å; R30-D33 PolarHBondContact NH1-OD2 3.3Å; R30-D33 IonicContact NH2-OD1 2.72Å; R30-D33 IonicContact NH2-OD2 2.77Å; R30-D33 PolarHBondContact NH2-OD2 2.76Å; H31-D33 PolarHBondContact O-N 3.2Å; D33-A35 VanDerWaalsContact C-N 3.31Å; D33-A35 PolarHBondContact O-N 2.88Å; D33-A35 PolarHBondContact OD1-N 2.87Å; D33-E36 PolarHBondContact O-N 2.85Å; D33-E36 PolarHBondContact OD1-N 2.8Å; D33-R37 WeakPolarHBondContact O-CB 3.49Å; D33-R37 VanDerWaalsContact O-CG 3.32Å; D33-R37 WeakPolarHBondContact O-CG 3.21Å; D33-R37 PolarHBondContact O-N 3.43Å; D33-P66 WeakPolarHBondContact OD2-CG 3.5Å
34	F	96.6	Very high	96.7	Very high	133 Å²	133	59.3 Å²	59.3	58%	0.583	29%	0.292	S	S	*	.	H	α-helix	trans	-58.6	-42.6	-176.6	-176.2	-93.5	0	0	0	112.6	E36 R37 H38 Y67	F34-E36 VanDerWaalsContact C-N 3.32Å; F34-E36 PolarHBondContact O-N 2.82Å; F34-R37 PolarHBondContact O-N 3.13Å; F34-H38 AromaticContact CD2-CE1 3.5Å; F34-H38 AromaticContact CD2-ND1 3.3Å; F34-H38 VanDerWaalsContact CD2-ND1 3.3Å; F34-H38 WeakPolarHBondContact CD2-ND1 3.32Å; F34-H38 AromaticContact CE2-CE1 3.37Å; F34-H38 WeakPolarHBondContact CE2-CE1 3.48Å; F34-H38 AromaticContact CE2-ND1 3.25Å; F34-H38 WeakPolarHBondContact CE2-ND1 3.22Å; F34-H38 AromaticContact CG-ND1 3.82Å; F34-H38 HydrophobicContact CZ-CB 4.48Å; F34-H38 AromaticContact CZ-ND1 3.73Å; F34-H38 PolarHBondContact O-N 2.77Å; F34-H38 VanDerWaalsContact O-N 3.11Å; F34-H38 PolarHBondContact O-ND1 2.82Å; F34-Y67 WeakPolarHBondContact CB-OH 3.49Å
35	A	95.5	Very high	96.7	Very high	25 Å²	25	53.8 Å²	53.8	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-60.1	-42.8	-179.2	0	0	0	0	0	111.6	D33 G39 Y40	D33-A35 VanDerWaalsContact C-N 3.31Å; D33-A35 PolarHBondContact O-N 2.88Å; D33-A35 PolarHBondContact OD1-N 2.87Å; A35-G39 CarbonylContact O-C 3.54Å; A35-G39 VanDerWaalsContact O-CA 3.28Å; A35-G39 WeakPolarHBondContact O-CA 3.44Å; A35-G39 PolarHBondContact O-N 2.91Å; A35-Y40 PolarHBondContact O-N 2.68Å
36	E	95	Very high	96.8	Very high	4 Å²	4	58 Å²	58	2%	0.019	28%	0.277	C	S	.	.	H	α-helix	trans	-79	-30.2	-177.3	-153	167.7	167.8	0	0	113.2	R30 D33 F34 C90 G91 K92 R163	R30-E36 IonicContact NH1-OE2 3.34Å; R30-E36 PolarHBondContact NH1-OE2 2.95Å; D33-E36 PolarHBondContact O-N 2.85Å; D33-E36 PolarHBondContact OD1-N 2.8Å; F34-E36 VanDerWaalsContact C-N 3.32Å; F34-E36 PolarHBondContact O-N 2.82Å; E36-C90 HydrophobicContact CG-CB 4.29Å; E36-C90 WeakPolarHBondContact OE1-CB 3.42Å; E36-G91 VanDerWaalsContact CG-CA 3.48Å; E36-G91 VanDerWaalsContact O-CA 3.26Å; E36-G91 WeakPolarHBondContact O-CA 3.28Å; E36-K92 PolarHBondContact O-N 3.41Å; E36-R163 WeakPolarHBondContact OE1-CD 3.38Å; E36-R163 IonicContact OE1-CZ 3.8Å; E36-R163 IonicContact OE1-NE 2.96Å; E36-R163 IonicContact OE1-NH1 3.73Å; E36-R163 PolarHBondContact OE1-NH1 2.72Å; E36-R163 IonicContact OE2-NH1 2.85Å; E36-R163 PolarHBondContact OE2-NH1 2.88Å
37	R	94.8	Very high	96.9	Very high	148 Å²	148	57.5 Å²	57.5	56%	0.558	27%	0.265	S	S	*	.	H	α-helix	trans	-70.8	-41.5	176.8	-73.9	178.3	-171.7	175.9	3.6	113.1	I32 D33 F34	I32-R37 HydrophobicContact CD1-CG 4.01Å; I32-R37 HydrophobicContact CG1-CG 3.87Å; D33-R37 WeakPolarHBondContact O-CB 3.49Å; D33-R37 VanDerWaalsContact O-CG 3.32Å; D33-R37 WeakPolarHBondContact O-CG 3.21Å; D33-R37 PolarHBondContact O-N 3.43Å; F34-R37 PolarHBondContact O-N 3.13Å
38	H	95.9	Very high	96.9	Very high	107 Å²	107	60.2 Å²	60.2	50%	0.495	28%	0.278	S	S	.	.	H	α-helix	trans	-106.4	-22.2	-172	-59.5	95.4	0	0	0	114	F34 K93	F34-H38 AromaticContact CD2-CE1 3.5Å; F34-H38 AromaticContact CD2-ND1 3.3Å; F34-H38 VanDerWaalsContact CD2-ND1 3.3Å; F34-H38 WeakPolarHBondContact CD2-ND1 3.32Å; F34-H38 AromaticContact CE2-CE1 3.37Å; F34-H38 WeakPolarHBondContact CE2-CE1 3.48Å; F34-H38 AromaticContact CE2-ND1 3.25Å; F34-H38 WeakPolarHBondContact CE2-ND1 3.22Å; F34-H38 AromaticContact CG-ND1 3.82Å; F34-H38 HydrophobicContact CZ-CB 4.48Å; F34-H38 AromaticContact CZ-ND1 3.73Å; F34-H38 PolarHBondContact O-N 2.77Å; F34-H38 VanDerWaalsContact O-N 3.11Å; F34-H38 PolarHBondContact O-ND1 2.82Å; H38-K93 WeakPolarHBondContact O-CD 3.45Å; H38-K93 WeakPolarHBondContact O-CE 3.47Å
39	G	97.1	Very high	96.9	Very high	19 Å²	19	57.3 Å²	57.3	20%	0.196	27%	0.266	C	S	.	.	S	Bend	trans	-138.1	-135	-175.5	0	0	0	0	0	112.1	A35 G91 K92 K93	A35-G39 CarbonylContact O-C 3.54Å; A35-G39 VanDerWaalsContact O-CA 3.28Å; A35-G39 WeakPolarHBondContact O-CA 3.44Å; A35-G39 PolarHBondContact O-N 2.91Å; G39-G91 CarbonylContact O-C 3.28Å; G39-G91 WeakPolarHBondContact O-CA 3.34Å; G39-K92 PolarHBondContact O-N 2.96Å; G39-K93 PolarHBondContact O-N 3.03Å
40	Y	97.4	Very high	97	Very high	132 Å²	132	63 Å²	63	52%	0.518	29%	0.293	S	S	.	.			trans	-144.3	157.5	170.3	62.9	-97.2	0	0	0	109.8	A35 Y89 C90 K93	A35-Y40 PolarHBondContact O-N 2.68Å; Y40-Y89 AromaticContact CD2-CD1 3.74Å; Y40-Y89 HydrophobicContact CD2-CD1 3.74Å; Y40-Y89 HydrophobicContact CD2-CE1 4.41Å; Y40-Y89 AromaticContact CE2-CD1 3.98Å; Y40-Y89 HydrophobicContact CE2-CD1 3.98Å; Y40-Y89 HydrophobicContact CE2-CE1 4.19Å; Y40-C90 CarbonylContact C-O 3.51Å; Y40-C90 VanDerWaalsContact CA-O 3.23Å; Y40-C90 WeakPolarHBondContact CA-O 3.29Å; Y40-K93 HydrophobicContact CD1-CB 4.04Å
41	I	97.6	Very high	97	Very high	18 Å²	18	62.3 Å²	62.3	9%	0.092	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.6	169.8	-167.7	170.9	0	0	0	109.3	F63 R64 C90	I41-F63 HydrophobicContact CD1-CD1 4.44Å; I41-F63 HydrophobicContact CG1-CD1 4.21Å; I41-F63 HydrophobicContact CG2-CD1 4.07Å; I41-F63 HydrophobicContact CG2-CE1 4.15Å; I41-R64 WeakPolarHBondContact CD1-O 3.45Å; I41-C90 HydrophobicContact CG2-CB 4.01Å; I41-C90 PolarHBondContact N-O 3.3Å; I41-C90 PolarHBondContact O-N 2.87Å
42	K	97.5	Very high	97.2	Very high	125 Å²	125	58.6 Å²	58.6	54%	0.543	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	136.7	175.6	71.9	-179.7	-178	-178	0	110.9	F63 I88 Y89	K42-F63 WeakPolarHBondContact O-CD1 3.5Å; K42-I88 CarbonylContact C-O 3.55Å; K42-I88 WeakPolarHBondContact CA-O 3.33Å; K42-Y89 HydrophobicContact CB-CD1 3.88Å; K42-Y89 HydrophobicContact CB-CE1 3.73Å
43	G	97.6	Very high	97.3	Very high	2 Å²	2	57.7 Å²	57.7	2%	0.021	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	148.2	170.2	0	0	0	0	0	110.2	A62 F63 F87 I88	G43-A62 CarbonylContact C-O 3.47Å; G43-A62 WeakPolarHBondContact CA-O 3.4Å; G43-F63 VanDerWaalsContact CA-CD1 3.43Å; G43-F63 VanDerWaalsContact CA-CE1 3.48Å; G43-F87 CarbonylContact O-C 3.12Å; G43-F87 WeakPolarHBondContact O-CA 3.23Å; G43-I88 PolarHBondContact N-O 2.97Å; G43-I88 PolarHBondContact O-N 2.82Å
44	I	98.3	Very high	97.4	Very high	45 Å²	45	59.9 Å²	59.9	23%	0.231	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.3	176.3	-171.3	168.7	0	0	0	109.8	K46 V61 A62 F87	I44-K46 HydrophobicContact CG2-CD 3.91Å; I44-K46 HydrophobicContact CG2-CG 4.21Å; I44-K46 PolarHBondContact O-N 3.1Å; I44-K46 VanDerWaalsContact O-N 3.14Å; I44-V61 WeakPolarHBondContact O-CA 3.03Å; I44-A62 HydrophobicContact CG2-CB 4.08Å; I44-A62 PolarHBondContact N-O 3.36Å; I44-A62 PolarHBondContact O-N 2.82Å; I44-F87 HydrophobicContact CB-CD1 4.32Å; I44-F87 HydrophobicContact CB-CE1 4.24Å; I44-F87 HydrophobicContact CD1-CE1 4.39Å; I44-F87 HydrophobicContact CG1-CE1 4.48Å
45	V	98.4	Very high	97.4	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	106.4	170.3	-178	0	0	0	0	107.9	I48 A59 V61 I82 H83 G85 Q86 I88	V45-I48 HydrophobicContact CG1-CG1 4.02Å; V45-A59 HydrophobicContact CG1-CB 4.26Å; V45-V61 HydrophobicContact CG2-CG2 4.44Å; V45-I82 HydrophobicContact CG1-CG2 4.2Å; V45-I82 HydrophobicContact CG2-CG2 3.84Å; V45-H83 WeakPolarHBondContact CB-O 3.35Å; V45-G85 PolarHBondContact O-N 3.13Å; V45-Q86 HydrophobicContact CG2-CB 4.36Å; V45-Q86 PolarHBondContact N-O 3.15Å; V45-I88 HydrophobicContact CG2-CD1 3.36Å; V45-I88 HydrophobicContact CG2-CG1 3.83Å
46	K	98.3	Very high	97.5	Very high	123 Å²	123	53.8 Å²	53.8	54%	0.535	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-36.6	-179.8	-73.8	-58.9	-168.6	-177.3	0	112.5	I44 K60 A62	I44-K46 HydrophobicContact CG2-CD 3.91Å; I44-K46 HydrophobicContact CG2-CG 4.21Å; I44-K46 PolarHBondContact O-N 3.1Å; I44-K46 VanDerWaalsContact O-N 3.14Å; K46-K60 PolarHBondContact N-O 3.5Å; K46-A62 HydrophobicContact CG-CB 3.73Å
47	D	98.3	Very high	97.6	Very high	58 Å²	58	55.1 Å²	55.1	31%	0.31	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	146.3	-167.1	-175	14.4	0	0	0	109.4	I49 K60	D47-I49 HydrophobicContact CB-CG2 4.39Å; D47-I49 VanDerWaalsContact CG-CG2 3.45Å; D47-I49 WeakPolarHBondContact OD2-CG2 3.34Å; D47-K60 HydrophobicContact CB-CB 4.26Å; D47-K60 HydrophobicContact CB-CD 4.12Å; D47-K60 PolarHBondContact O-N 2.72Å; D47-K60 IonicContact OD2-NZ 2.63Å; D47-K60 PolarHBondContact OD2-NZ 3.4Å
48	I	98.3	Very high	97.8	Very high	60 Å²	60	48 Å²	48	31%	0.308	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	112.8	174.8	-60.2	176.2	0	0	0	107.5	V45 P57 L58 I82 T84	V45-I48 HydrophobicContact CG1-CG1 4.02Å; I48-P57 HydrophobicContact CG2-CB 3.95Å; I48-L58 CarbonylContact C-O 3.56Å; I48-L58 WeakPolarHBondContact CA-O 3.42Å; I48-I82 HydrophobicContact CD1-CG2 4.29Å; I48-I82 VanDerWaalsContact CD1-O 3.3Å; I48-I82 WeakPolarHBondContact CD1-O 3.42Å; I48-T84 HydrophobicContact CG1-CG2 4.29Å
49	I	98.3	Very high	97.9	Very high	21 Å²	21	43 Å²	43	11%	0.108	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	151.4	-169.2	68.6	-178	0	0	0	112.2	K24 D47 L58 K60 L75	K24-I49 HydrophobicContact CB-CD1 3.68Å; K24-I49 HydrophobicContact CG-CD1 3.75Å; K24-I49 HydrophobicContact CG-CG1 4.45Å; D47-I49 HydrophobicContact CB-CG2 4.39Å; D47-I49 VanDerWaalsContact CG-CG2 3.45Å; D47-I49 WeakPolarHBondContact OD2-CG2 3.34Å; I49-L58 HydrophobicContact CD1-CB 4.4Å; I49-L58 HydrophobicContact CG1-CB 3.86Å; I49-L58 PolarHBondContact N-O 3.33Å; I49-L58 PolarHBondContact O-N 3.05Å; I49-K60 HydrophobicContact CD1-CD 4.5Å; I49-K60 HydrophobicContact CD1-CG 4.16Å; I49-K60 HydrophobicContact CG2-CD 4.49Å; I49-L75 HydrophobicContact CD1-CD2 4Å
50	H	98.4	Very high	98	Very high	120 Å²	120	45.5 Å²	45.5	56%	0.556	22%	0.223	S	C	*	.			trans	-82.2	130.7	166.8	-174.8	67.7	0	0	0	111.6	R54	H50-R54 PolarHBondContact CE1-O 3.01Å
51	D	98.3	Very high	98	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.011	20%	0.199	C	C	.	.			trans	-103.6	111.8	173.6	-179.1	39.6	0	0	0	110.4	R23 K24 G53 R54 L58	R23-D51 VanDerWaalsContact CA-OD1 3.31Å; R23-D51 WeakPolarHBondContact CA-OD1 3.49Å; R23-D51 WeakPolarHBondContact CB-OD1 3.5Å; K24-D51 HydrophobicContact CG-CB 4.49Å; K24-D51 PolarHBondContact N-OD1 3.4Å; D51-G53 PolarHBondContact O-N 2.85Å; D51-R54 HydrophobicContact CB-CB 4.11Å; D51-R54 VanDerWaalsContact O-CB 3.25Å; D51-R54 WeakPolarHBondContact O-CB 3.41Å; D51-R54 PolarHBondContact O-N 3.03Å; D51-R54 IonicContact OD2-CZ 3.94Å; D51-R54 IonicContact OD2-NE 3.32Å; D51-R54 PolarHBondContact OD2-NE 3.18Å; D51-R54 IonicContact OD2-NH2 3Å; D51-L58 HydrophobicContact CB-CD1 3.6Å; D51-L58 HydrophobicContact CB-CG 3.81Å
52	P	98.1	Very high	98.1	Very high	33 Å²	33	39 Å²	39	21%	0.214	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	130.5	-176.8	-30.3	37.1	0	0	0	113.8	H22 R54	H22-P52 HydrophobicContact CB-CB 4.47Å; H22-P52 HydrophobicContact CB-CG 4.06Å; H22-P52 WeakPolarHBondContact O-CD 3.41Å; H22-P52 WeakPolarHBondContact O-CG 3.25Å; P52-R54 VanDerWaalsContact C-N 3.29Å
53	G	97	Very high	98.1	Very high	16 Å²	16	33.1 Å²	33.1	17%	0.165	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	-5.3	-178.7	0	0	0	0	0	114.6	D51 K192	D51-G53 PolarHBondContact O-N 2.85Å; G53-K192 VanDerWaalsContact O-CE 3.24Å; G53-K192 WeakPolarHBondContact O-CE 2.72Å; G53-K192 PolarHBondContact O-NZ 3.15Å; G53-K192 VanDerWaalsContact O-NZ 3.15Å
54	R	97.9	Very high	98.1	Very high	67 Å²	67	41.9 Å²	41.9	25%	0.253	21%	0.206	S	C	.	.			trans	-102.5	144.9	171	-171.8	-177.4	-67.4	-82.2	-2.4	110.3	H50 D51 P52 A56	H50-R54 PolarHBondContact CE1-O 3.01Å; D51-R54 HydrophobicContact CB-CB 4.11Å; D51-R54 VanDerWaalsContact O-CB 3.25Å; D51-R54 WeakPolarHBondContact O-CB 3.41Å; D51-R54 PolarHBondContact O-N 3.03Å; D51-R54 IonicContact OD2-CZ 3.94Å; D51-R54 IonicContact OD2-NE 3.32Å; D51-R54 PolarHBondContact OD2-NE 3.18Å; D51-R54 IonicContact OD2-NH2 3Å; P52-R54 VanDerWaalsContact C-N 3.29Å; R54-A56 WeakPolarHBondContact CD-O 3.39Å; R54-A56 HydrophobicContact CG-CB 4.31Å; R54-A56 VanDerWaalsContact CG-O 3.24Å; R54-A56 WeakPolarHBondContact CG-O 3.26Å
55	G	96.9	Very high	97.9	Very high	29 Å²	29	40.1 Å²	40.1	30%	0.299	20%	0.197	S	C	.	.	S	Bend	trans	-86.7	-31.9	174	0	0	0	0	0	113.5
56	A	97.9	Very high	97.7	Very high	1 Å²	1	43 Å²	43	1%	0.008	22%	0.216	C	C	.	.	S	Bend	trans	-83.7	139.2	178	0	0	0	0	0	110.7	R54 I77 V169	R54-A56 WeakPolarHBondContact CD-O 3.39Å; R54-A56 HydrophobicContact CG-CB 4.31Å; R54-A56 VanDerWaalsContact CG-O 3.24Å; R54-A56 WeakPolarHBondContact CG-O 3.26Å; A56-I77 HydrophobicContact CB-CG2 4.05Å; A56-V169 HydrophobicContact CB-CG1 3.45Å; A56-V169 VanDerWaalsContact CB-CG1 3.45Å
57	P	98.3	Very high	97.5	Very high	31 Å²	31	44.5 Å²	44.5	20%	0.201	22%	0.219	C	C	.	.			trans	-69.9	158.9	171	28.9	-31.2	0	0	0	111.4	I48 A78 A170	I48-P57 HydrophobicContact CG2-CB 3.95Å; P57-A78 HydrophobicContact CG-CB 4.24Å; P57-A78 PolarHBondContact O-N 2.84Å; P57-A170 HydrophobicContact CG-CB 3.71Å
58	L	98.4	Very high	97.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	143.9	173.9	-59.1	-173.2	0	0	0	110.2	K24 A27 I48 I49 D51 F76 I77	K24-L58 HydrophobicContact CB-CD1 4.47Å; A27-L58 HydrophobicContact CB-CD1 4.25Å; A27-L58 HydrophobicContact CB-CD2 3.5Å; I48-L58 CarbonylContact C-O 3.56Å; I48-L58 WeakPolarHBondContact CA-O 3.42Å; I49-L58 HydrophobicContact CD1-CB 4.4Å; I49-L58 HydrophobicContact CG1-CB 3.86Å; I49-L58 PolarHBondContact N-O 3.33Å; I49-L58 PolarHBondContact O-N 3.05Å; D51-L58 HydrophobicContact CB-CD1 3.6Å; D51-L58 HydrophobicContact CB-CG 3.81Å; L58-F76 CarbonylContact C-O 3.57Å; L58-F76 WeakPolarHBondContact CA-O 3.44Å; L58-F76 WeakPolarHBondContact CB-O 3.46Å; L58-I77 HydrophobicContact CD2-CG1 4.06Å
59	A	98.4	Very high	97.2	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.2	170.3	0	0	0	0	0	109.4	V45 V61 F76 A78	V45-A59 HydrophobicContact CG1-CB 4.26Å; A59-V61 HydrophobicContact CB-CG2 4.18Å; A59-V61 PolarHBondContact O-N 2.83Å; A59-F76 HydrophobicContact CB-CB 4.49Å; A59-F76 PolarHBondContact N-O 2.79Å; A59-F76 PolarHBondContact O-N 3.14Å; A59-A78 HydrophobicContact CB-CB 4.22Å
60	K	98.3	Very high	97.1	Very high	73 Å²	73	63.6 Å²	63.6	32%	0.317	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	107.2	167.2	-70.9	-177.9	-165.4	148.6	0	108.2	K46 D47 I49 T73 L75	K46-K60 PolarHBondContact N-O 3.5Å; D47-K60 HydrophobicContact CB-CB 4.26Å; D47-K60 HydrophobicContact CB-CD 4.12Å; D47-K60 PolarHBondContact O-N 2.72Å; D47-K60 IonicContact OD2-NZ 2.63Å; D47-K60 PolarHBondContact OD2-NZ 3.4Å; I49-K60 HydrophobicContact CD1-CD 4.5Å; I49-K60 HydrophobicContact CD1-CG 4.16Å; I49-K60 HydrophobicContact CG2-CD 4.49Å; K60-T73 HydrophobicContact CB-CG2 4.26Å; K60-L75 HydrophobicContact CG-CD2 3.64Å
61	V	98.3	Very high	96.9	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.9	-178.9	-168.8	0	0	0	0	109.1	I44 V45 A59 F63 T73 E74 F76 I88	I44-V61 WeakPolarHBondContact O-CA 3.03Å; V45-V61 HydrophobicContact CG2-CG2 4.44Å; A59-V61 HydrophobicContact CB-CG2 4.18Å; A59-V61 PolarHBondContact O-N 2.83Å; V61-F63 HydrophobicContact CB-CE2 3.8Å; V61-F63 HydrophobicContact CB-CZ 4.29Å; V61-F63 HydrophobicContact CG1-CD2 4.12Å; V61-F63 HydrophobicContact CG1-CE1 4.26Å; V61-F63 HydrophobicContact CG1-CE2 3.43Å; V61-F63 VanDerWaalsContact CG1-CE2 3.43Å; V61-F63 HydrophobicContact CG1-CZ 3.5Å; V61-T73 WeakPolarHBondContact O-CA 3.44Å; V61-E74 PolarHBondContact N-O 2.88Å; V61-E74 PolarHBondContact O-N 3.19Å; V61-F76 HydrophobicContact CG2-CB 4.16Å; V61-F76 HydrophobicContact CG2-CD2 4Å; V61-F76 HydrophobicContact CG2-CG 4Å; V61-I88 HydrophobicContact CG1-CB 4.45Å; V61-I88 HydrophobicContact CG1-CD1 4.37Å; V61-I88 HydrophobicContact CG2-CD1 3.81Å
62	A	98.1	Very high	96.8	Very high	12 Å²	12	71.2 Å²	71.2	10%	0.099	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	117.9	178.2	0	0	0	0	0	110.3	G43 I44 K46	G43-A62 CarbonylContact C-O 3.47Å; G43-A62 WeakPolarHBondContact CA-O 3.4Å; I44-A62 HydrophobicContact CG2-CB 4.08Å; I44-A62 PolarHBondContact N-O 3.36Å; I44-A62 PolarHBondContact O-N 2.82Å; K46-A62 HydrophobicContact CG-CB 3.73Å
63	F	97.8	Very high	96.7	Very high	3 Å²	3	74 Å²	74	1%	0.013	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	150.8	174.1	-64.5	-85.2	0	0	0	110.2	I41 K42 G43 V61 K71 R72 E74 F76	I41-F63 HydrophobicContact CD1-CD1 4.44Å; I41-F63 HydrophobicContact CG1-CD1 4.21Å; I41-F63 HydrophobicContact CG2-CD1 4.07Å; I41-F63 HydrophobicContact CG2-CE1 4.15Å; K42-F63 WeakPolarHBondContact O-CD1 3.5Å; G43-F63 VanDerWaalsContact CA-CD1 3.43Å; G43-F63 VanDerWaalsContact CA-CE1 3.48Å; V61-F63 HydrophobicContact CB-CE2 3.8Å; V61-F63 HydrophobicContact CB-CZ 4.29Å; V61-F63 HydrophobicContact CG1-CD2 4.12Å; V61-F63 HydrophobicContact CG1-CE1 4.26Å; V61-F63 HydrophobicContact CG1-CE2 3.43Å; V61-F63 VanDerWaalsContact CG1-CE2 3.43Å; V61-F63 HydrophobicContact CG1-CZ 3.5Å; F63-K71 CarbonylContact O-C 3.58Å; F63-K71 WeakPolarHBondContact O-CA 3.21Å; F63-R72 PolarHBondContact N-O 2.93Å; F63-R72 PolarHBondContact O-N 2.87Å; F63-E74 HydrophobicContact CD2-CB 4.47Å; F63-E74 HydrophobicContact CD2-CG 4.2Å; F63-E74 HydrophobicContact CE2-CB 4.27Å; F63-E74 HydrophobicContact CE2-CG 4.33Å; F63-F76 HydrophobicContact CE2-CE1 4.31Å; F63-F76 HydrophobicContact CE2-CE2 4.47Å; F63-F76 AromaticContact CE2-CZ 3.87Å; F63-F76 HydrophobicContact CE2-CZ 3.87Å; F63-F76 HydrophobicContact CZ-CE2 4.2Å; F63-F76 AromaticContact CZ-CZ 3.9Å; F63-F76 HydrophobicContact CZ-CZ 3.9Å
64	R	97.3	Very high	96.7	Very high	186 Å²	186	74.8 Å²	74.8	70%	0.702	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	133	163.5	-170.2	163.8	70.8	120	-2.6	108.4	I41	I41-R64 WeakPolarHBondContact CD1-O 3.45Å
65	D	95.6	Very high	96.7	Very high	8 Å²	8	73.1 Å²	73.1	4%	0.043	33%	0.331	C	S	.	.			trans	-66.5	127.8	175.5	-171.8	-34	0	0	0	109	Y67 R68 K70 R72	D65-Y67 VanDerWaalsContact C-N 3.25Å; D65-Y67 PolarHBondContact O-N 3.36Å; D65-Y67 PolarHBondContact OD1-N 3.22Å; D65-R68 WeakPolarHBondContact CB-O 3.31Å; D65-R68 PolarHBondContact OD1-N 3.06Å; D65-K70 HydrophobicContact CB-CB 4.46Å; D65-K70 VanDerWaalsContact CB-O 3.25Å; D65-K70 WeakPolarHBondContact CB-O 3.5Å; D65-K70 PolarHBondContact N-O 2.86Å; D65-R72 HydrophobicContact CB-CG 4.25Å; D65-R72 IonicContact OD1-NH2 3.92Å; D65-R72 IonicContact OD2-CZ 3.14Å; D65-R72 IonicContact OD2-NE 2.7Å; D65-R72 PolarHBondContact OD2-NE 3.01Å; D65-R72 IonicContact OD2-NH2 2.77Å; D65-R72 PolarHBondContact OD2-NH2 3.33Å
66	P	93.4	Very high	96.8	Very high	60 Å²	60	72 Å²	72	39%	0.39	32%	0.318	S	S	.	.	S	Bend	trans	-72.1	-16.9	-178.1	25.9	-31.7	0	0	0	113.7	D33	D33-P66 WeakPolarHBondContact OD2-CG 3.5Å
67	Y	94.6	Very high	96.8	Very high	154 Å²	154	72 Å²	72	60%	0.604	32%	0.318	S	S	*	.	S	Bend	trans	-112.4	-16.7	-174.7	-57.7	-71.8	0	0	0	114	F34 D65	F34-Y67 WeakPolarHBondContact CB-OH 3.49Å; D65-Y67 VanDerWaalsContact C-N 3.25Å; D65-Y67 PolarHBondContact O-N 3.36Å; D65-Y67 PolarHBondContact OD1-N 3.22Å
68	R	94.9	Very high	96.8	Very high	190 Å²	190	70.7 Å²	70.7	72%	0.717	31%	0.31	S	S	*	.	S	Bend	trans	-138.6	152.8	-175.5	-61.1	-176.8	-176.1	-175.8	0.2	110.4	D65 K70	D65-R68 WeakPolarHBondContact CB-O 3.31Å; D65-R68 PolarHBondContact OD1-N 3.06Å; R68-K70 PolarHBondContact O-N 2.89Å
69	F	95.6	Very high	96.8	Very high	205 Å²	205	70.8 Å²	70.8	90%	0.899	31%	0.31	S	S	*	.	S	Bend	trans	-74.9	71.8	173.1	-169.7	-106.4	0	0	0	111.3
70	K	95.9	Very high	96.7	Very high	145 Å²	145	76.2 Å²	76.2	63%	0.63	34%	0.336	S	S	*	.			trans	-146.4	153.7	179.4	-173.9	170.8	-179.5	173.7	0	110.7	D65 R68	D65-K70 HydrophobicContact CB-CB 4.46Å; D65-K70 VanDerWaalsContact CB-O 3.25Å; D65-K70 WeakPolarHBondContact CB-O 3.5Å; D65-K70 PolarHBondContact N-O 2.86Å; R68-K70 PolarHBondContact O-N 2.89Å
71	K	94.9	Very high	96.6	Very high	162 Å²	162	75.7 Å²	75.7	70%	0.704	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	131	167.8	-66.9	175.2	-176.9	167.1	0	109.6	F63	F63-K71 CarbonylContact O-C 3.58Å; F63-K71 WeakPolarHBondContact O-CA 3.21Å
72	R	95.1	Very high	96.5	Very high	121 Å²	121	76.6 Å²	76.6	46%	0.457	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.4	171.3	-69	-166.2	-174.2	-165.4	7	109.6	F63 D65	F63-R72 PolarHBondContact N-O 2.93Å; F63-R72 PolarHBondContact O-N 2.87Å; D65-R72 HydrophobicContact CB-CG 4.25Å; D65-R72 IonicContact OD1-NH2 3.92Å; D65-R72 IonicContact OD2-CZ 3.14Å; D65-R72 IonicContact OD2-NE 2.7Å; D65-R72 PolarHBondContact OD2-NE 3.01Å; D65-R72 IonicContact OD2-NH2 2.77Å; D65-R72 PolarHBondContact OD2-NH2 3.33Å
73	T	96.3	Very high	96.5	Very high	90 Å²	90	81.2 Å²	81.2	55%	0.552	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	127	175.5	-54.7	0	0	0	0	109.4	K60 V61	K60-T73 HydrophobicContact CB-CG2 4.26Å; V61-T73 WeakPolarHBondContact O-CA 3.44Å
74	E	97.5	Very high	96.5	Very high	34 Å²	34	85 Å²	85	16%	0.159	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	150.6	175.4	-66.3	-72.8	-174.3	0	0	110	R30 V61 F63 F76 R123	R30-E74 HydrophobicContact CG-CG 4.5Å; V61-E74 PolarHBondContact N-O 2.88Å; V61-E74 PolarHBondContact O-N 3.19Å; F63-E74 HydrophobicContact CD2-CB 4.47Å; F63-E74 HydrophobicContact CD2-CG 4.2Å; F63-E74 HydrophobicContact CE2-CB 4.27Å; F63-E74 HydrophobicContact CE2-CG 4.33Å; E74-F76 HydrophobicContact CB-CD1 3.96Å; E74-F76 HydrophobicContact CB-CE1 3.59Å; E74-F76 HydrophobicContact CG-CE1 4.33Å; E74-R123 VanDerWaalsContact CD-NH2 3.34Å; E74-R123 IonicContact OE1-NH2 2.68Å; E74-R123 PolarHBondContact OE1-NH2 2.87Å; E74-R123 IonicContact OE2-CZ 3.4Å; E74-R123 IonicContact OE2-NH2 3.33Å; E74-R123 PolarHBondContact OE2-NH2 2.8Å
75	L	98	Very high	96.6	Very high	31 Å²	31	78.1 Å²	78.1	16%	0.162	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	102.1	176.4	-72.5	171.8	0	0	0	109.3	K24 A27 K28 I49 K60	K24-L75 WeakPolarHBondContact O-CD1 3.28Å; A27-L75 CarbonylContact C-O 3.59Å; A27-L75 WeakPolarHBondContact CA-O 2.74Å; K28-L75 PolarHBondContact N-O 3.37Å; K28-L75 VanDerWaalsContact O-O 3.13Å; I49-L75 HydrophobicContact CD1-CD2 4Å; K60-L75 HydrophobicContact CG-CD2 3.64Å
76	F	98	Very high	96.7	Very high	5 Å²	5	79.7 Å²	79.7	2%	0.022	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	156.7	176.4	-74.7	16.8	0	0	0	109.8	K28 R30 L58 A59 V61 F63 E74 I88 V101	K28-F76 WeakPolarHBondContact O-CD1 3.05Å; K28-F76 WeakPolarHBondContact O-CE1 3.14Å; R30-F76 HydrophobicContact CB-CE1 4.42Å; R30-F76 HydrophobicContact CB-CZ 4.16Å; L58-F76 CarbonylContact C-O 3.57Å; L58-F76 WeakPolarHBondContact CA-O 3.44Å; L58-F76 WeakPolarHBondContact CB-O 3.46Å; A59-F76 HydrophobicContact CB-CB 4.49Å; A59-F76 PolarHBondContact N-O 2.79Å; A59-F76 PolarHBondContact O-N 3.14Å; V61-F76 HydrophobicContact CG2-CB 4.16Å; V61-F76 HydrophobicContact CG2-CD2 4Å; V61-F76 HydrophobicContact CG2-CG 4Å; F63-F76 HydrophobicContact CE2-CE1 4.31Å; F63-F76 HydrophobicContact CE2-CE2 4.47Å; F63-F76 AromaticContact CE2-CZ 3.87Å; F63-F76 HydrophobicContact CE2-CZ 3.87Å; F63-F76 HydrophobicContact CZ-CE2 4.2Å; F63-F76 AromaticContact CZ-CZ 3.9Å; F63-F76 HydrophobicContact CZ-CZ 3.9Å; E74-F76 HydrophobicContact CB-CD1 3.96Å; E74-F76 HydrophobicContact CB-CE1 3.59Å; E74-F76 HydrophobicContact CG-CE1 4.33Å; F76-I88 HydrophobicContact CE2-CG2 4.42Å; F76-V101 HydrophobicContact CE2-CG2 3.9Å
77	I	98.3	Very high	96.9	Very high	3 Å²	3	81.5 Å²	81.5	2%	0.015	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	129.7	160.1	-63.2	-176.3	0	0	0	106.2	A27 A56 L58 A79 R128 V169	A27-I77 HydrophobicContact CB-CG1 3.85Å; A56-I77 HydrophobicContact CB-CG2 4.05Å; L58-I77 HydrophobicContact CD2-CG1 4.06Å; I77-A79 PolarHBondContact O-N 3.33Å; I77-R128 HydrophobicContact CD1-CB 3.63Å; I77-R128 HydrophobicContact CD1-CG 4.15Å; I77-R128 VanDerWaalsContact CD1-NE 3.3Å; I77-R128 VanDerWaalsContact CD1-NH2 3.34Å; I77-R128 WeakPolarHBondContact CD1-O 3.21Å; I77-V169 HydrophobicContact CG2-CB 4.47Å; I77-V169 HydrophobicContact CG2-CG1 3.49Å; I77-V169 VanDerWaalsContact CG2-CG1 3.49Å; I77-V169 HydrophobicContact CG2-CG2 4.25Å
78	A	98	Very high	97	Very high	3 Å²	3	74.2 Å²	74.2	3%	0.025	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-72.8	130.4	179.6	0	0	0	0	0	110.4	P57 A59 A170	P57-A78 HydrophobicContact CG-CB 4.24Å; P57-A78 PolarHBondContact O-N 2.84Å; A59-A78 HydrophobicContact CB-CB 4.22Å; A78-A170 HydrophobicContact CB-CB 4.44Å; A78-A170 WeakPolarHBondContact O-CB 3.43Å; A78-A170 PolarHBondContact O-N 3.17Å
79	A	98	Very high	97.2	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.008	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-74	152.1	160.1	0	0	0	0	0	109.3	I77 I82 I98 V165 V168	I77-A79 PolarHBondContact O-N 3.33Å; A79-I82 HydrophobicContact CB-CD1 3.91Å; A79-I82 HydrophobicContact CB-CG1 4.24Å; A79-I82 WeakPolarHBondContact O-CB 3.4Å; A79-I82 WeakPolarHBondContact O-CG1 3.33Å; A79-I82 PolarHBondContact O-N 2.88Å; A79-I98 HydrophobicContact CB-CG2 4.31Å; A79-V165 HydrophobicContact CB-CG1 3.98Å; A79-V168 CarbonylContact C-O 3.44Å; A79-V168 WeakPolarHBondContact CA-O 3.19Å
80	E	97	Very high	97.3	Very high	115 Å²	115	58.9 Å²	58.9	54%	0.537	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	141.4	173.8	-169.1	162	-172.2	0	0	110.6	I82 I98 V168 A170	E80-I82 VanDerWaalsContact C-N 3.32Å; E80-I98 VanDerWaalsContact O-CG2 3.22Å; E80-I98 WeakPolarHBondContact O-CG2 3.28Å; E80-V168 PolarHBondContact N-O 3.33Å; E80-A170 HydrophobicContact CB-CB 4.44Å
81	G	95.8	Very high	97.3	Very high	61 Å²	61	52 Å²	52	63%	0.629	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-8.3	-173.2	0	0	0	0	0	115.1
82	I	97.1	Very high	97.4	Very high	19 Å²	19	50.1 Å²	50.1	10%	0.097	27%	0.265	C	S	.	.			trans	-70.8	136.8	172.6	-66.3	-179.4	0	0	0	110.9	V45 I48 A79 E80 Q86 I88	V45-I82 HydrophobicContact CG1-CG2 4.2Å; V45-I82 HydrophobicContact CG2-CG2 3.84Å; I48-I82 HydrophobicContact CD1-CG2 4.29Å; I48-I82 VanDerWaalsContact CD1-O 3.3Å; I48-I82 WeakPolarHBondContact CD1-O 3.42Å; A79-I82 HydrophobicContact CB-CD1 3.91Å; A79-I82 HydrophobicContact CB-CG1 4.24Å; A79-I82 WeakPolarHBondContact O-CB 3.4Å; A79-I82 WeakPolarHBondContact O-CG1 3.33Å; A79-I82 PolarHBondContact O-N 2.88Å; E80-I82 VanDerWaalsContact C-N 3.32Å; I82-Q86 VanDerWaalsContact CA-OE1 3.23Å; I82-I88 HydrophobicContact CD1-CD1 4.15Å
83	H	98	Very high	97.5	Very high	110 Å²	110	51.6 Å²	51.6	51%	0.509	27%	0.274	S	S	.	.			trans	-130.3	163.2	175.8	62.2	86.6	0	0	0	112.5	V45 Q86	V45-H83 WeakPolarHBondContact CB-O 3.35Å; H83-Q86 VanDerWaalsContact O-CB 3.25Å; H83-Q86 WeakPolarHBondContact O-CB 3.35Å; H83-Q86 PolarHBondContact O-N 2.65Å
84	T	98.2	Very high	97.6	Very high	82 Å²	82	47.9 Å²	47.9	50%	0.503	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	144.4	173.3	48.1	0	0	0	0	110.9	I48 Q86	I48-T84 HydrophobicContact CG1-CG2 4.29Å; T84-Q86 PolarHBondContact O-N 2.91Å
85	G	97.7	Very high	97.5	Very high	42 Å²	42	52.8 Å²	52.8	43%	0.433	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	-16	-175.3	0	0	0	0	0	114.5	V45	V45-G85 PolarHBondContact O-N 3.13Å
86	Q	97.9	Very high	97.5	Very high	40 Å²	40	54.7 Å²	54.7	19%	0.187	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-63.3	140.7	177.9	-167.1	-177	-2.6	0	0	111.7	V45 I82 H83 T84	V45-Q86 HydrophobicContact CG2-CB 4.36Å; V45-Q86 PolarHBondContact N-O 3.15Å; I82-Q86 VanDerWaalsContact CA-OE1 3.23Å; H83-Q86 VanDerWaalsContact O-CB 3.25Å; H83-Q86 WeakPolarHBondContact O-CB 3.35Å; H83-Q86 PolarHBondContact O-N 2.65Å; T84-Q86 PolarHBondContact O-N 2.91Å
87	F	98.1	Very high	97.4	Very high	98 Å²	98	58.7 Å²	58.7	43%	0.43	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	124.5	168	-67.1	-66.9	0	0	0	110.7	G43 I44 Y89	G43-F87 CarbonylContact O-C 3.12Å; G43-F87 WeakPolarHBondContact O-CA 3.23Å; I44-F87 HydrophobicContact CB-CD1 4.32Å; I44-F87 HydrophobicContact CB-CE1 4.24Å; I44-F87 HydrophobicContact CD1-CE1 4.39Å; I44-F87 HydrophobicContact CG1-CE1 4.48Å; F87-Y89 HydrophobicContact CB-CE2 3.83Å
88	I	97.6	Very high	97.4	Very high	1 Å²	1	63 Å²	63	1%	0.005	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.8	169.4	-68.4	173.9	0	0	0	108	K42 G43 V45 V61 F76 I82 G99	K42-I88 CarbonylContact C-O 3.55Å; K42-I88 WeakPolarHBondContact CA-O 3.33Å; G43-I88 PolarHBondContact N-O 2.97Å; G43-I88 PolarHBondContact O-N 2.82Å; V45-I88 HydrophobicContact CG2-CD1 3.36Å; V45-I88 HydrophobicContact CG2-CG1 3.83Å; V61-I88 HydrophobicContact CG1-CB 4.45Å; V61-I88 HydrophobicContact CG1-CD1 4.37Å; V61-I88 HydrophobicContact CG2-CD1 3.81Å; F76-I88 HydrophobicContact CE2-CG2 4.42Å; I82-I88 HydrophobicContact CD1-CD1 4.15Å; I88-G99 VanDerWaalsContact CG2-O 3.28Å; I88-G99 WeakPolarHBondContact CG2-O 3.22Å
89	Y	98.1	Very high	97.3	Very high	74 Å²	74	62.9 Å²	62.9	29%	0.29	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.7	175.7	-59.7	-90.4	0	0	0	109.6	Y40 K42 F87 N100 V101	Y40-Y89 AromaticContact CD2-CD1 3.74Å; Y40-Y89 HydrophobicContact CD2-CD1 3.74Å; Y40-Y89 HydrophobicContact CD2-CE1 4.41Å; Y40-Y89 AromaticContact CE2-CD1 3.98Å; Y40-Y89 HydrophobicContact CE2-CD1 3.98Å; Y40-Y89 HydrophobicContact CE2-CE1 4.19Å; K42-Y89 HydrophobicContact CB-CD1 3.88Å; K42-Y89 HydrophobicContact CB-CE1 3.73Å; F87-Y89 HydrophobicContact CB-CE2 3.83Å; Y89-N100 PolarHBondContact N-OD1 3.01Å; Y89-N100 WeakPolarHBondContact O-CA 3.45Å; Y89-N100 WeakPolarHBondContact O-CB 3.42Å; Y89-V101 PolarHBondContact O-N 3.44Å
90	C	97.7	Very high	97.3	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	121.5	177.5	-57.9	0	0	0	0	109.8	E36 Y40 I41 V101	E36-C90 HydrophobicContact CG-CB 4.29Å; E36-C90 WeakPolarHBondContact OE1-CB 3.42Å; Y40-C90 CarbonylContact C-O 3.51Å; Y40-C90 VanDerWaalsContact CA-O 3.23Å; Y40-C90 WeakPolarHBondContact CA-O 3.29Å; I41-C90 HydrophobicContact CG2-CB 4.01Å; I41-C90 PolarHBondContact N-O 3.3Å; I41-C90 PolarHBondContact O-N 2.87Å; C90-V101 CarbonylContact C-O 3.47Å; C90-V101 WeakPolarHBondContact CA-O 3.05Å; C90-V101 HydrophobicContact CB-CB 4.1Å
91	G	97	Very high	97.4	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.303	C	S	.	.	S	Bend	trans	146.7	175.7	171.8	0	0	0	0	0	114.9	E36 G39 K93 A94 V101	E36-G91 VanDerWaalsContact CG-CA 3.48Å; E36-G91 VanDerWaalsContact O-CA 3.26Å; E36-G91 WeakPolarHBondContact O-CA 3.28Å; G39-G91 CarbonylContact O-C 3.28Å; G39-G91 WeakPolarHBondContact O-CA 3.34Å; G91-K93 VanDerWaalsContact C-N 3.32Å; G91-K93 PolarHBondContact O-N 3.07Å; G91-A94 WeakPolarHBondContact O-CB 3.29Å; G91-A94 PolarHBondContact O-N 3Å; G91-V101 PolarHBondContact N-O 3.07Å
92	K	96.7	Very high	97.5	Very high	123 Å²	123	54.9 Å²	54.9	54%	0.535	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-35.1	-177.7	-174.6	177.6	177.3	-177.1	0	113.5	E36 G39 P103 T106	E36-K92 PolarHBondContact O-N 3.41Å; G39-K92 PolarHBondContact O-N 2.96Å; K92-P103 HydrophobicContact CB-CG 4.22Å; K92-P103 HydrophobicContact CG-CG 4.48Å; K92-T106 HydrophobicContact CG-CG2 4.12Å
93	K	97	Very high	97.5	Very high	151 Å²	151	54.8 Å²	54.8	66%	0.657	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	9.9	-179	-63.8	-171.6	179.9	179.3	0	113.5	H38 G39 Y40 G91	H38-K93 WeakPolarHBondContact O-CD 3.45Å; H38-K93 WeakPolarHBondContact O-CE 3.47Å; G39-K93 PolarHBondContact O-N 3.03Å; Y40-K93 HydrophobicContact CD1-CB 4.04Å; G91-K93 VanDerWaalsContact C-N 3.32Å; G91-K93 PolarHBondContact O-N 3.07Å
94	A	97.3	Very high	97.5	Very high	12 Å²	12	49.6 Å²	49.6	10%	0.099	25%	0.251	C	S	.	.			trans	-68.9	153.3	175.7	0	0	0	0	0	110.4	G91 L102	G91-A94 WeakPolarHBondContact O-CB 3.29Å; G91-A94 PolarHBondContact O-N 3Å; A94-L102 HydrophobicContact CB-CD2 4.11Å; A94-L102 HydrophobicContact CB-CG 4.05Å; A94-L102 WeakPolarHBondContact O-CD2 3.21Å
95	Q	96.7	Very high	97.4	Very high	137 Å²	137	47.4 Å²	47.4	64%	0.64	25%	0.245	S	C	*	.			trans	-77.2	151.3	173.8	-70.8	178.6	-20.7	0	0	111.1	N97 N100	Q95-N97 VanDerWaalsContact C-N 3.32Å; Q95-N97 PolarHBondContact O-N 2.89Å; Q95-N100 PolarHBondContact O-ND2 2.79Å
96	L	97	Very high	97.3	Very high	72 Å²	72	48.4 Å²	48.4	38%	0.377	24%	0.243	S	C	.	.	S	Bend	trans	-79.9	75.1	-178.9	-167.9	114	0	0	0	111.7	M107 P108 T111 V166	L96-M107 HydrophobicContact CD1-CB 3.83Å; L96-M107 HydrophobicContact CD1-CG 3.75Å; L96-P108 HydrophobicContact CD2-CG 4.48Å; L96-T111 HydrophobicContact CD1-CG2 4.29Å; L96-V166 HydrophobicContact CG-CG2 4.48Å
97	N	96.9	Very high	97.3	Very high	89 Å²	89	46.7 Å²	46.7	48%	0.476	24%	0.235	S	C	.	.			trans	-121.8	156.8	177.1	-65.5	-15.3	0	0	0	110.9	Q95 G99 N100 V166	Q95-N97 VanDerWaalsContact C-N 3.32Å; Q95-N97 PolarHBondContact O-N 2.89Å; N97-G99 PolarHBondContact O-N 2.94Å; N97-N100 WeakPolarHBondContact O-CB 3.29Å; N97-N100 PolarHBondContact O-N 2.86Å; N97-N100 VanDerWaalsContact O-N 3.09Å; N97-V166 WeakPolarHBondContact O-CB 3.42Å
98	I	97.6	Very high	97.3	Very high	92 Å²	92	45.7 Å²	45.7	47%	0.472	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	131.5	178.8	-64.2	172.9	0	0	0	110.5	A79 E80 N100	A79-I98 HydrophobicContact CB-CG2 4.31Å; E80-I98 VanDerWaalsContact O-CG2 3.22Å; E80-I98 WeakPolarHBondContact O-CG2 3.28Å; I98-N100 VanDerWaalsContact C-N 3.31Å; I98-N100 PolarHBondContact O-N 2.84Å
99	G	96.1	Very high	97.3	Very high	1 Å²	1	51 Å²	51	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	-17.1	-179.6	0	0	0	0	0	115	I88 N97 V166	I88-G99 VanDerWaalsContact CG2-O 3.28Å; I88-G99 WeakPolarHBondContact CG2-O 3.22Å; N97-G99 PolarHBondContact O-N 2.94Å; G99-V166 PolarHBondContact N-O 2.85Å
100	N	98.2	Very high	97.3	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.016	27%	0.273	C	S	.	.			trans	-69.7	152.5	173.9	-70.8	-12.3	0	0	0	111.5	Y89 Q95 N97 I98 L102 V165 V166	Y89-N100 PolarHBondContact N-OD1 3.01Å; Y89-N100 WeakPolarHBondContact O-CA 3.45Å; Y89-N100 WeakPolarHBondContact O-CB 3.42Å; Q95-N100 PolarHBondContact O-ND2 2.79Å; N97-N100 WeakPolarHBondContact O-CB 3.29Å; N97-N100 PolarHBondContact O-N 2.86Å; N97-N100 VanDerWaalsContact O-N 3.09Å; I98-N100 VanDerWaalsContact C-N 3.31Å; I98-N100 PolarHBondContact O-N 2.84Å; N100-L102 HydrophobicContact CB-CD1 3.79Å; N100-V165 CarbonylContact O-C 3.58Å; N100-V165 WeakPolarHBondContact O-CA 3.41Å; N100-V166 PolarHBondContact O-N 2.68Å
101	V	98.3	Very high	97.3	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.3	179.6	-176.2	0	0	0	0	109	L29 F76 Y89 C90 G91 R163 A164 V165	L29-V101 HydrophobicContact CD1-CG1 4.14Å; L29-V101 HydrophobicContact CD2-CG1 4.44Å; L29-V101 HydrophobicContact CD2-CG2 4.2Å; F76-V101 HydrophobicContact CE2-CG2 3.9Å; Y89-V101 PolarHBondContact O-N 3.44Å; C90-V101 CarbonylContact C-O 3.47Å; C90-V101 WeakPolarHBondContact CA-O 3.05Å; C90-V101 HydrophobicContact CB-CB 4.1Å; G91-V101 PolarHBondContact N-O 3.07Å; V101-R163 HydrophobicContact CG1-CB 3.94Å; V101-A164 WeakPolarHBondContact CA-O 3.32Å; V101-V165 HydrophobicContact CG2-CG2 3.84Å
102	L	97.8	Very high	97.4	Very high	5 Å²	5	54 Å²	54	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	158.6	179.8	-50.5	89	0	0	0	110.5	A94 N100 M107 R163 A164 V166	A94-L102 HydrophobicContact CB-CD2 4.11Å; A94-L102 HydrophobicContact CB-CG 4.05Å; A94-L102 WeakPolarHBondContact O-CD2 3.21Å; N100-L102 HydrophobicContact CB-CD1 3.79Å; L102-M107 HydrophobicContact CB-CE 3.59Å; L102-M107 HydrophobicContact CB-CG 4.44Å; L102-M107 HydrophobicContact CD1-CE 3.99Å; L102-M107 HydrophobicContact CG-CE 4.39Å; L102-M107 VanDerWaalsContact O-CE 3.32Å; L102-M107 WeakPolarHBondContact O-CE 3.38Å; L102-R163 VanDerWaalsContact O-CA 3.29Å; L102-R163 WeakPolarHBondContact O-CA 3.3Å; L102-A164 PolarHBondContact N-O 3.33Å; L102-A164 VanDerWaalsContact N-O 3.14Å; L102-A164 PolarHBondContact O-N 3.36Å; L102-V166 HydrophobicContact CD1-CG2 3.57Å
103	P	97.9	Very high	97.4	Very high	18 Å²	18	48.2 Å²	48.2	12%	0.117	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	140.7	163.4	-20.8	33.7	0	0	0	110.8	K92 G105 T106 N162	K92-P103 HydrophobicContact CB-CG 4.22Å; K92-P103 HydrophobicContact CG-CG 4.48Å; P103-G105 PolarHBondContact O-N 2.9Å; P103-T106 HydrophobicContact CB-CG2 4.48Å; P103-T106 PolarHBondContact O-N 3.21Å; P103-T106 PolarHBondContact O-OG1 3.15Å; P103-N162 CarbonylContact C-O 3.56Å; P103-N162 WeakPolarHBondContact CA-O 3.19Å
104	V	97.5	Very high	97.5	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-61.4	-35.8	-179.6	173.4	0	0	0	0	111.1	T106 M107 I113 L116 V136 H139 V148 I158 S160 N162 A164	V104-T106 PolarHBondContact O-N 3.29Å; V104-M107 PolarHBondContact O-N 2.87Å; V104-M107 VanDerWaalsContact O-N 3.14Å; V104-I113 HydrophobicContact CG2-CD1 4.09Å; V104-L116 HydrophobicContact CG2-CD1 3.57Å; V104-V136 HydrophobicContact CG1-CG1 4.34Å; V104-V136 HydrophobicContact CG1-CG2 3.96Å; V104-H139 PolarHBondContact O-CE1 2.85Å; V104-V148 HydrophobicContact CG1-CG2 4.25Å; V104-I158 HydrophobicContact CB-CD1 4.4Å; V104-I158 HydrophobicContact CG1-CD1 4.31Å; V104-I158 HydrophobicContact CG2-CD1 4.04Å; V104-S160 PolarHBondContact N-O 3.04Å; V104-N162 WeakPolarHBondContact CG2-O 3.36Å; V104-N162 PolarHBondContact N-O 2.86Å; V104-A164 HydrophobicContact CG2-CB 4.21Å
105	G	96.7	Very high	97.5	Very high	36 Å²	36	40.5 Å²	40.5	37%	0.371	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-67.8	-11.1	-179.5	0	0	0	0	0	115.9	P103 S160	P103-G105 PolarHBondContact O-N 2.9Å; G105-S160 PolarHBondContact N-O 3.18Å
106	T	96.3	Very high	97.6	Very high	64 Å²	64	34 Å²	34	39%	0.393	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-99.5	-8.6	174.9	58.2	0	0	0	0	112.6	K92 P103 V104	K92-T106 HydrophobicContact CG-CG2 4.12Å; P103-T106 HydrophobicContact CB-CG2 4.48Å; P103-T106 PolarHBondContact O-N 3.21Å; P103-T106 PolarHBondContact O-OG1 3.15Å; V104-T106 PolarHBondContact O-N 3.29Å
107	M	97.4	Very high	97.6	Very high	4 Å²	4	30.6 Å²	30.6	2%	0.02	19%	0.187	C	C	.	.	S	Bend	trans	-86.2	142.3	176.4	-56.9	-178.9	-176.5	0	0	108.9	L96 L102 V104 T111 I113 H139 A164 V166	L96-M107 HydrophobicContact CD1-CB 3.83Å; L96-M107 HydrophobicContact CD1-CG 3.75Å; L102-M107 HydrophobicContact CB-CE 3.59Å; L102-M107 HydrophobicContact CB-CG 4.44Å; L102-M107 HydrophobicContact CD1-CE 3.99Å; L102-M107 HydrophobicContact CG-CE 4.39Å; L102-M107 VanDerWaalsContact O-CE 3.32Å; L102-M107 WeakPolarHBondContact O-CE 3.38Å; V104-M107 PolarHBondContact O-N 2.87Å; V104-M107 VanDerWaalsContact O-N 3.14Å; M107-T111 HydrophobicContact CB-CG2 4.24Å; M107-T111 HydrophobicContact SD-CG2 4.09Å; M107-I113 HydrophobicContact CE-CG2 4.15Å; M107-I113 HydrophobicContact SD-CG2 3.34Å; M107-I113 WeakPolarHBondContact SD-CG2 3.43Å; M107-H139 PolarHBondContact O-CE1 3.25Å; M107-H139 PolarHBondContact O-NE2 3.19Å; M107-A164 HydrophobicContact CE-CB 4.39Å; M107-A164 WeakPolarHBondContact CE-O 3.42Å; M107-V166 HydrophobicContact CE-CG2 3.69Å; M107-V166 HydrophobicContact SD-CG2 4.14Å
108	P	97.7	Very high	97.6	Very high	77 Å²	77	30.5 Å²	30.5	50%	0.5	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-68.2	159.9	174.8	27.8	-31.9	0	0	0	111.5	L96 T111	L96-P108 HydrophobicContact CD2-CG 4.48Å; P108-T111 WeakPolarHBondContact CD-OG1 3.24Å; P108-T111 WeakPolarHBondContact CG-OG1 3.15Å; P108-T111 VanDerWaalsContact O-CB 3.3Å; P108-T111 WeakPolarHBondContact O-CB 3.03Å; P108-T111 PolarHBondContact O-N 3.24Å; P108-T111 PolarHBondContact O-OG1 3.47Å
109	E	97.8	Very high	97.5	Very high	113 Å²	113	33.3 Å²	33.3	53%	0.528	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	148.3	173.3	-58.4	-175.1	169.3	0	0	110.7	T111 S138 H139	E109-T111 PolarHBondContact O-N 3.39Å; E109-S138 WeakPolarHBondContact OE1-CA 3.46Å; E109-H139 IonicContact OE1-CD2 2.77Å; E109-H139 PolarHBondContact OE1-N 3.4Å; E109-H139 VanDerWaalsContact OE1-N 3.15Å
110	G	97.3	Very high	97.4	Very high	48 Å²	48	36.9 Å²	36.9	50%	0.495	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	-9.3	-173.8	0	0	0	0	0	114.8	I112 V136	G110-I112 PolarHBondContact O-N 2.87Å; G110-V136 WeakPolarHBondContact CA-O 3.4Å; G110-V136 PolarHBondContact N-O 2.8Å
111	T	98.2	Very high	97.3	Very high	16 Å²	16	37.9 Å²	37.9	10%	0.098	23%	0.227	C	C	.	.			trans	-59.2	131.7	178.6	-57.2	0	0	0	0	111.5	L96 M107 P108 E109 I113 V136 V166	L96-T111 HydrophobicContact CD1-CG2 4.29Å; M107-T111 HydrophobicContact CB-CG2 4.24Å; M107-T111 HydrophobicContact SD-CG2 4.09Å; P108-T111 WeakPolarHBondContact CD-OG1 3.24Å; P108-T111 WeakPolarHBondContact CG-OG1 3.15Å; P108-T111 VanDerWaalsContact O-CB 3.3Å; P108-T111 WeakPolarHBondContact O-CB 3.03Å; P108-T111 PolarHBondContact O-N 3.24Å; P108-T111 PolarHBondContact O-OG1 3.47Å; E109-T111 PolarHBondContact O-N 3.39Å; T111-I113 HydrophobicContact CG2-CG2 3.9Å; T111-V136 PolarHBondContact O-N 3.14Å; T111-V136 VanDerWaalsContact O-N 3.08Å; T111-V166 HydrophobicContact CG2-CG1 4.34Å
112	I	98.4	Very high	97.2	Very high	73 Å²	73	39.7 Å²	39.7	37%	0.374	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	123.9	174.5	-60.8	178.5	0	0	0	109.1	G110 Y133 G167 V168	G110-I112 PolarHBondContact O-N 2.87Å; I112-Y133 HydrophobicContact CG2-CD2 3.76Å; I112-Y133 HydrophobicContact CG2-CG 3.82Å; I112-G167 PolarHBondContact O-N 3.17Å; I112-V168 HydrophobicContact CG2-CG2 3.7Å
113	I	98.4	Very high	97.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	155.6	-175.3	59.1	171.3	0	0	0	112.2	V104 M107 T111 L116 Y133 A134 V136 V148 A164 V165 G167	V104-I113 HydrophobicContact CG2-CD1 4.09Å; M107-I113 HydrophobicContact CE-CG2 4.15Å; M107-I113 HydrophobicContact SD-CG2 3.34Å; M107-I113 WeakPolarHBondContact SD-CG2 3.43Å; T111-I113 HydrophobicContact CG2-CG2 3.9Å; I113-L116 HydrophobicContact CD1-CD1 4.19Å; I113-L116 HydrophobicContact CD1-CD2 4.34Å; I113-Y133 CarbonylContact O-C 3.51Å; I113-Y133 WeakPolarHBondContact O-CA 3.29Å; I113-A134 HydrophobicContact CG1-CB 4.11Å; I113-A134 WeakPolarHBondContact CG1-O 3.44Å; I113-A134 PolarHBondContact N-O 3.18Å; I113-A134 PolarHBondContact O-N 3.14Å; I113-V136 HydrophobicContact CD1-CG2 3.87Å; I113-V136 HydrophobicContact CG1-CG2 4.39Å; I113-V136 HydrophobicContact CG2-CG2 4.42Å; I113-V148 HydrophobicContact CD1-CG1 4.41Å; I113-A164 HydrophobicContact CB-CB 3.84Å; I113-A164 HydrophobicContact CD1-CB 3.79Å; I113-A164 HydrophobicContact CG1-CB 4.29Å; I113-A164 HydrophobicContact CG2-CB 4.26Å; I113-V165 CarbonylContact C-O 3.34Å; I113-V165 VanDerWaalsContact CA-O 3.27Å; I113-V165 WeakPolarHBondContact CA-O 3.32Å; I113-G167 CarbonylContact C-O 3.52Å; I113-G167 VanDerWaalsContact C-O 3.28Å
114	C	98.4	Very high	97	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.007	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	172.6	172.6	66.4	0	0	0	0	112	L116 A127 V165 G167 V169	C114-L116 PolarHBondContact O-N 2.8Å; C114-L116 VanDerWaalsContact O-N 3.13Å; C114-A127 WeakPolarHBondContact CB-O 3.27Å; C114-V165 PolarHBondContact N-O 2.85Å; C114-V165 PolarHBondContact O-N 2.9Å; C114-G167 WeakPolarHBondContact CB-O 3.39Å; C114-G167 PolarHBondContact N-O 2.86Å; C114-G167 PolarHBondContact SG-O 3.31Å; C114-V169 HydrophobicContact CB-CG2 3.49Å; C114-V169 VanDerWaalsContact CB-CG2 3.49Å
115	C	97.9	Very high	97	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.007	26%	0.263	C	S	.	.	S	Bend	trans	53	35	-178.1	-153.7	0	0	0	0	114.3	L29 G124 L126 A127 V165	L29-C115 HydrophobicContact CD2-CB 4.29Å; C115-G124 WeakPolarHBondContact O-CA 3.44Å; C115-L126 CarbonylContact C-O 3.58Å; C115-L126 WeakPolarHBondContact CA-O 3.36Å; C115-L126 PolarHBondContact N-O 2.96Å; C115-A127 PolarHBondContact N-O 3.01Å; C115-V165 HydrophobicContact CB-CB 4.44Å; C115-V165 HydrophobicContact CB-CG2 3.9Å
116	L	98	Very high	97	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-65.9	136.6	-175.3	167.9	67	0	0	0	112.3	V104 I113 C114 K125 L126 V148 I158 A164	V104-L116 HydrophobicContact CG2-CD1 3.57Å; I113-L116 HydrophobicContact CD1-CD1 4.19Å; I113-L116 HydrophobicContact CD1-CD2 4.34Å; C114-L116 PolarHBondContact O-N 2.8Å; C114-L116 VanDerWaalsContact O-N 3.13Å; L116-K125 PolarHBondContact O-N 3.14Å; L116-L126 HydrophobicContact CB-CB 4.06Å; L116-L126 HydrophobicContact CD2-CB 4.27Å; L116-L126 HydrophobicContact CD2-CD1 4.03Å; L116-L126 HydrophobicContact CG-CB 4.28Å; L116-L126 HydrophobicContact CG-CD1 4.28Å; L116-L126 PolarHBondContact N-O 3Å; L116-L126 PolarHBondContact O-N 2.97Å; L116-V148 HydrophobicContact CD2-CB 4.45Å; L116-V148 HydrophobicContact CD2-CG1 3.93Å; L116-V148 HydrophobicContact CD2-CG2 4.5Å; L116-I158 HydrophobicContact CD1-CD1 3.61Å; L116-I158 HydrophobicContact CD2-CD1 4.04Å; L116-I158 HydrophobicContact CG-CD1 4.3Å; L116-A164 HydrophobicContact CB-CB 4.12Å; L116-A164 HydrophobicContact CD1-CB 3.93Å
117	E	98	Very high	97.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.			trans	-71.9	137.5	170.3	-64.4	-171.5	149.6	0	0	111.5	L29 G121 D122 R123 N162 R163	L29-E117 HydrophobicContact CD1-CG 4.04Å; E117-G121 PolarHBondContact OE2-N 3.2Å; E117-D122 VanDerWaalsContact CA-OD1 3.22Å; E117-D122 WeakPolarHBondContact CA-OD1 3.3Å; E117-D122 WeakPolarHBondContact CB-OD1 3.25Å; E117-D122 VanDerWaalsContact CG-OD1 3.29Å; E117-D122 WeakPolarHBondContact CG-OD1 3.42Å; E117-R123 WeakPolarHBondContact OE1-CA 3.43Å; E117-R123 PolarHBondContact OE1-N 3.44Å; E117-R123 VanDerWaalsContact OE1-N 3.13Å; E117-N162 HydrophobicContact CB-CB 4.02Å; E117-N162 PolarHBondContact O-ND2 3.33Å; E117-R163 HydrophobicContact CG-CB 4.45Å; E117-R163 WeakPolarHBondContact CG-O 3.4Å; E117-R163 PolarHBondContact N-O 2.62Å; E117-R163 IonicContact OE1-CZ 3.2Å; E117-R163 IonicContact OE1-NE 3.64Å; E117-R163 PolarHBondContact OE1-NE 3.08Å; E117-R163 IonicContact OE1-NH2 2.64Å; E117-R163 PolarHBondContact OE1-NH2 3.33Å; E117-R163 PolarHBondContact OE2-N 3.49Å; E117-R163 IonicContact OE2-NE 3.3Å; E117-R163 PolarHBondContact OE2-NE 3.27Å
118	E	95.4	Very high	97.1	Very high	87 Å²	87	46 Å²	46	41%	0.407	25%	0.246	S	C	.	.	S	Bend	trans	-83.6	-41.4	171.8	175.5	171.9	-164.6	0	0	110.7	D122 K125 L126 K156 N162	E118-D122 WeakPolarHBondContact CA-OD2 3.25Å; E118-D122 WeakPolarHBondContact CB-OD2 3.43Å; E118-D122 PolarHBondContact N-OD2 3.13Å; E118-K125 HydrophobicContact CB-CB 4.42Å; E118-L126 HydrophobicContact CB-CD1 4.14Å; E118-L126 HydrophobicContact CB-CG 4.34Å; E118-K156 IonicContact OE1-NZ 3.61Å; E118-K156 PolarHBondContact OE1-NZ 3.48Å; E118-N162 PolarHBondContact O-ND2 3.48Å
119	K	95.8	Very high	97.1	Very high	150 Å²	150	44.7 Å²	44.7	65%	0.652	24%	0.242	S	C	*	.	S	Bend	trans	-121.9	149.5	170.7	-63.1	-175.7	-179	-175.8	0	109.7	G121 D122	K119-G121 PolarHBondContact O-N 3.09Å; K119-D122 PolarHBondContact N-OD2 3.38Å; K119-D122 WeakPolarHBondContact O-CB 3.35Å; K119-D122 PolarHBondContact O-N 3.35Å; K119-D122 VanDerWaalsContact O-N 3.1Å
120	P	94.8	Very high	97.1	Very high	76 Å²	76	40.3 Å²	40.3	49%	0.494	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	125.4	-178.4	-20.7	28.7	0	0	0	111.1	D122 A159 N162	P120-D122 PolarHBondContact O-N 2.94Å; P120-A159 HydrophobicContact CG-CB 4.16Å; P120-N162 WeakPolarHBondContact CA-OD1 3.3Å; P120-N162 WeakPolarHBondContact CD-OD1 3.45Å; P120-N162 WeakPolarHBondContact CG-OD1 3.34Å
121	G	94.8	Very high	97.1	Very high	25 Å²	25	39.1 Å²	39.1	26%	0.258	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	6.3	176.6	0	0	0	0	0	115.8	E117 K119 R123	E117-G121 PolarHBondContact OE2-N 3.2Å; K119-G121 PolarHBondContact O-N 3.09Å; G121-R123 WeakPolarHBondContact O-CG 3.4Å; G121-R123 PolarHBondContact O-N 2.94Å; G121-R123 VanDerWaalsContact O-N 3.15Å
122	D	96.4	Very high	97.1	Very high	38 Å²	38	41.4 Å²	41.4	20%	0.203	22%	0.223	C	C	.	.	S	Bend	trans	-72.1	-0.6	173.6	75	11.2	0	0	0	114.1	E117 E118 K119 P120 G124 K125	E117-D122 VanDerWaalsContact CA-OD1 3.22Å; E117-D122 WeakPolarHBondContact CA-OD1 3.3Å; E117-D122 WeakPolarHBondContact CB-OD1 3.25Å; E117-D122 VanDerWaalsContact CG-OD1 3.29Å; E117-D122 WeakPolarHBondContact CG-OD1 3.42Å; E118-D122 WeakPolarHBondContact CA-OD2 3.25Å; E118-D122 WeakPolarHBondContact CB-OD2 3.43Å; E118-D122 PolarHBondContact N-OD2 3.13Å; K119-D122 PolarHBondContact N-OD2 3.38Å; K119-D122 WeakPolarHBondContact O-CB 3.35Å; K119-D122 PolarHBondContact O-N 3.35Å; K119-D122 VanDerWaalsContact O-N 3.1Å; P120-D122 PolarHBondContact O-N 2.94Å; D122-G124 VanDerWaalsContact C-N 3.32Å; D122-G124 PolarHBondContact O-N 2.91Å; D122-G124 PolarHBondContact OD1-N 2.78Å; D122-G124 VanDerWaalsContact OD1-N 3.07Å; D122-K125 HydrophobicContact CB-CG 4.38Å; D122-K125 VanDerWaalsContact O-CE 3.29Å; D122-K125 WeakPolarHBondContact O-CE 3.37Å; D122-K125 VanDerWaalsContact OD2-CG 3.28Å; D122-K125 WeakPolarHBondContact OD2-CG 3.27Å
123	R	97.2	Very high	97.1	Very high	56 Å²	56	43.1 Å²	43.1	21%	0.211	23%	0.225	C	C	.	.			trans	64.2	28.7	173.7	-49.8	177.3	59.3	177.8	0.4	114.3	K28 L29 E74 E117 G121	K28-R123 WeakPolarHBondContact CA-O 3.47Å; K28-R123 HydrophobicContact CB-CB 3.93Å; K28-R123 HydrophobicContact CD-CB 4.46Å; K28-R123 HydrophobicContact CG-CB 4.43Å; L29-R123 HydrophobicContact CB-CB 4.42Å; L29-R123 PolarHBondContact N-O 3.4Å; L29-R123 PolarHBondContact O-NE 3.13Å; L29-R123 PolarHBondContact O-NH2 2.85Å; E74-R123 VanDerWaalsContact CD-NH2 3.34Å; E74-R123 IonicContact OE1-NH2 2.68Å; E74-R123 PolarHBondContact OE1-NH2 2.87Å; E74-R123 IonicContact OE2-CZ 3.4Å; E74-R123 IonicContact OE2-NH2 3.33Å; E74-R123 PolarHBondContact OE2-NH2 2.8Å; E117-R123 WeakPolarHBondContact OE1-CA 3.43Å; E117-R123 PolarHBondContact OE1-N 3.44Å; E117-R123 VanDerWaalsContact OE1-N 3.13Å; G121-R123 WeakPolarHBondContact O-CG 3.4Å; G121-R123 PolarHBondContact O-N 2.94Å; G121-R123 VanDerWaalsContact O-N 3.15Å
124	G	94.8	Very high	97.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.			trans	94	117	166.5	0	0	0	0	0	112.9	C115 D122 R128	C115-G124 WeakPolarHBondContact O-CA 3.44Å; D122-G124 VanDerWaalsContact C-N 3.32Å; D122-G124 PolarHBondContact O-N 2.91Å; D122-G124 PolarHBondContact OD1-N 2.78Å; D122-G124 VanDerWaalsContact OD1-N 3.07Å; G124-R128 WeakPolarHBondContact O-CD 3.46Å; G124-R128 PolarHBondContact O-NH1 2.63Å
125	K	96.8	Very high	97.1	Very high	115 Å²	115	44.9 Å²	44.9	50%	0.5	24%	0.236	S	C	.	.			trans	-128.7	-33.6	-174.8	-61.3	-64.7	179.2	175.6	0	113.7	L116 E118 D122 R128	L116-K125 PolarHBondContact O-N 3.14Å; E118-K125 HydrophobicContact CB-CB 4.42Å; D122-K125 HydrophobicContact CB-CG 4.38Å; D122-K125 VanDerWaalsContact O-CE 3.29Å; D122-K125 WeakPolarHBondContact O-CE 3.37Å; D122-K125 VanDerWaalsContact OD2-CG 3.28Å; D122-K125 WeakPolarHBondContact OD2-CG 3.27Å; K125-R128 WeakPolarHBondContact O-CD 3.46Å
126	L	97.9	Very high	97.1	Very high	29 Å²	29	44.9 Å²	44.9	15%	0.152	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-101.1	153.2	-171.4	-54.3	175.4	0	0	0	111.2	C115 L116 E118 R128 L150 K156	C115-L126 CarbonylContact C-O 3.58Å; C115-L126 WeakPolarHBondContact CA-O 3.36Å; C115-L126 PolarHBondContact N-O 2.96Å; L116-L126 HydrophobicContact CB-CB 4.06Å; L116-L126 HydrophobicContact CD2-CB 4.27Å; L116-L126 HydrophobicContact CD2-CD1 4.03Å; L116-L126 HydrophobicContact CG-CB 4.28Å; L116-L126 HydrophobicContact CG-CD1 4.28Å; L116-L126 PolarHBondContact N-O 3Å; L116-L126 PolarHBondContact O-N 2.97Å; E118-L126 HydrophobicContact CB-CD1 4.14Å; E118-L126 HydrophobicContact CB-CG 4.34Å; L126-R128 VanDerWaalsContact O-CG 3.27Å; L126-R128 WeakPolarHBondContact O-CG 3.36Å; L126-R128 PolarHBondContact O-N 2.83Å; L126-L150 HydrophobicContact CB-CD2 4.36Å; L126-L150 HydrophobicContact CD1-CD2 4.08Å; L126-K156 HydrophobicContact CD1-CD 4.46Å
127	A	97.4	Very high	97.1	Very high	10 Å²	10	47.5 Å²	47.5	8%	0.083	25%	0.25	C	C	.	.	S	Bend	trans	49.4	59.6	178.4	0	0	0	0	0	114.3	C114 C115 A134 P151 V169	C114-A127 WeakPolarHBondContact CB-O 3.27Å; C115-A127 PolarHBondContact N-O 3.01Å; A127-A134 HydrophobicContact CB-CB 4.05Å; A127-P151 HydrophobicContact CB-CG 3.95Å; A127-V169 WeakPolarHBondContact O-CG2 3.39Å
128	R	97.9	Very high	97	Very high	49 Å²	49	49.3 Å²	49.3	19%	0.185	26%	0.262	C	S	.	.			trans	-116.7	-6.1	-172.3	-60.6	-167.5	61.9	-170.8	-9.2	115.2	A27 I77 G124 K125 L126	A27-R128 VanDerWaalsContact C-NH2 3.33Å; A27-R128 PolarHBondContact O-NH1 2.85Å; A27-R128 PolarHBondContact O-NH2 3.11Å; I77-R128 HydrophobicContact CD1-CB 3.63Å; I77-R128 HydrophobicContact CD1-CG 4.15Å; I77-R128 VanDerWaalsContact CD1-NE 3.3Å; I77-R128 VanDerWaalsContact CD1-NH2 3.34Å; I77-R128 WeakPolarHBondContact CD1-O 3.21Å; G124-R128 WeakPolarHBondContact O-CD 3.46Å; G124-R128 PolarHBondContact O-NH1 2.63Å; K125-R128 WeakPolarHBondContact O-CD 3.46Å; L126-R128 VanDerWaalsContact O-CG 3.27Å; L126-R128 WeakPolarHBondContact O-CG 3.36Å; L126-R128 PolarHBondContact O-N 2.83Å
129	A	97.9	Very high	97.1	Very high	51 Å²	51	47.5 Å²	47.5	42%	0.421	25%	0.254	S	S	.	.	S	Bend	trans	-83.5	154.4	-179.4	0	0	0	0	0	110.1	G131 N132 V169	A129-G131 PolarHBondContact O-N 3.45Å; A129-N132 HydrophobicContact CB-CB 4.36Å; A129-N132 WeakPolarHBondContact O-CB 3.46Å; A129-N132 PolarHBondContact O-N 3.21Å; A129-V169 VanDerWaalsContact O-CB 3.26Å; A129-V169 WeakPolarHBondContact O-CB 3.34Å; A129-V169 WeakPolarHBondContact O-CG1 3.29Å
130	S	97.4	Very high	97.2	Very high	21 Å²	21	43.5 Å²	43.5	15%	0.147	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	122.6	179.5	59.6	0	0	0	0	111.7	N132 G171	S130-N132 VanDerWaalsContact C-N 3.29Å; S130-N132 PolarHBondContact O-N 2.94Å; S130-G171 VanDerWaalsContact CB-O 3.28Å; S130-G171 WeakPolarHBondContact CB-O 3.28Å
131	G	96.9	Very high	97.2	Very high	23 Å²	23	45.2 Å²	45.2	24%	0.237	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	80	-3.6	-177.1	0	0	0	0	0	115.9	A129 V169	A129-G131 PolarHBondContact O-N 3.45Å; G131-V169 WeakPolarHBondContact CA-O 3.36Å; G131-V169 PolarHBondContact N-O 3.15Å
132	N	98.1	Very high	97.2	Very high	64 Å²	64	52.4 Å²	52.4	34%	0.342	28%	0.277	S	S	.	.			trans	-85.7	146.7	178.6	-75.8	20.4	0	0	0	111.1	A129 S130 P151 V169	A129-N132 HydrophobicContact CB-CB 4.36Å; A129-N132 WeakPolarHBondContact O-CB 3.46Å; A129-N132 PolarHBondContact O-N 3.21Å; S130-N132 VanDerWaalsContact C-N 3.29Å; S130-N132 PolarHBondContact O-N 2.94Å; N132-P151 HydrophobicContact CB-CB 4.13Å; N132-P151 HydrophobicContact CB-CG 3.95Å; N132-V169 VanDerWaalsContact O-CG2 3.32Å; N132-V169 WeakPolarHBondContact O-CG2 3.17Å; N132-V169 PolarHBondContact O-N 2.82Å
133	Y	98.3	Very high	97.2	Very high	108 Å²	108	54 Å²	54	42%	0.424	29%	0.289	S	S	.	.			trans	-143.6	168.1	171.4	62.3	-86.9	0	0	0	110	I112 I113 P151 V168	I112-Y133 HydrophobicContact CG2-CD2 3.76Å; I112-Y133 HydrophobicContact CG2-CG 3.82Å; I113-Y133 CarbonylContact O-C 3.51Å; I113-Y133 WeakPolarHBondContact O-CA 3.29Å; Y133-P151 WeakPolarHBondContact O-CD 3.32Å; Y133-P151 WeakPolarHBondContact O-CG 3.26Å; Y133-V168 HydrophobicContact CD1-CG1 4.17Å; Y133-V168 HydrophobicContact CD1-CG2 4.06Å; Y133-V168 HydrophobicContact CG-CG2 4.21Å
134	A	98.3	Very high	97.1	Very high	1 Å²	1	59 Å²	59	1%	0.008	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	156.2	168.5	0	0	0	0	0	108.6	I113 A127 V148 K149	I113-A134 HydrophobicContact CG1-CB 4.11Å; I113-A134 WeakPolarHBondContact CG1-O 3.44Å; I113-A134 PolarHBondContact N-O 3.18Å; I113-A134 PolarHBondContact O-N 3.14Å; A127-A134 HydrophobicContact CB-CB 4.05Å; A134-V148 HydrophobicContact CB-CG1 3.67Å; A134-K149 WeakPolarHBondContact CA-O 3.46Å; A134-K149 VanDerWaalsContact CB-O 3.27Å; A134-K149 WeakPolarHBondContact CB-O 3.25Å
135	T	98.4	Very high	97.3	Very high	37 Å²	37	64.1 Å²	64.1	23%	0.227	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	130.5	-179.1	-54.5	0	0	0	0	109.2	I137 V148 K149	T135-I137 PolarHBondContact O-N 2.78Å; T135-V148 CarbonylContact O-C 3.59Å; T135-V148 WeakPolarHBondContact O-CA 3.45Å; T135-V148 WeakPolarHBondContact O-CG1 3.28Å; T135-K149 PolarHBondContact N-O 2.86Å; T135-K149 PolarHBondContact O-N 3.28Å
136	V	98.1	Very high	97.3	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	119.9	171.7	-177.1	0	0	0	0	108.1	V104 G110 T111 I113 H139	V104-V136 HydrophobicContact CG1-CG1 4.34Å; V104-V136 HydrophobicContact CG1-CG2 3.96Å; G110-V136 WeakPolarHBondContact CA-O 3.4Å; G110-V136 PolarHBondContact N-O 2.8Å; T111-V136 PolarHBondContact O-N 3.14Å; T111-V136 VanDerWaalsContact O-N 3.08Å; I113-V136 HydrophobicContact CD1-CG2 3.87Å; I113-V136 HydrophobicContact CG1-CG2 4.39Å; I113-V136 HydrophobicContact CG2-CG2 4.42Å; V136-H139 WeakPolarHBondContact CG1-CE1 3.32Å; V136-H139 VanDerWaalsContact CG1-NE2 3.32Å; V136-H139 WeakPolarHBondContact CG1-NE2 3.37Å
137	I	97.9	Very high	97.3	Very high	57 Å²	57	62.9 Å²	62.9	29%	0.292	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-57.9	-179.5	-64.2	165.8	0	0	0	109.6	T135 R147 K149 K155	T135-I137 PolarHBondContact O-N 2.78Å; I137-R147 HydrophobicContact CB-CB 4.43Å; I137-R147 HydrophobicContact CB-CG 4.34Å; I137-R147 WeakPolarHBondContact CB-O 3.24Å; I137-R147 HydrophobicContact CD1-CG 4.08Å; I137-R147 PolarHBondContact N-O 2.88Å; I137-K149 HydrophobicContact CD1-CB 3.76Å; I137-K149 HydrophobicContact CG1-CB 4.01Å; I137-K155 HydrophobicContact CD1-CB 4.3Å; I137-K155 HydrophobicContact CD1-CD 3.98Å; I137-K155 HydrophobicContact CD1-CG 3.71Å
138	S	97.5	Very high	97.3	Very high	37 Å²	37	62.4 Å²	62.4	26%	0.259	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	158.6	-176.7	65.4	0	0	0	0	113.2	E109 S146 R147	E109-S138 WeakPolarHBondContact OE1-CA 3.46Å; S138-S146 CarbonylContact O-C 3.58Å; S138-S146 WeakPolarHBondContact O-CA 3.06Å; S138-R147 PolarHBondContact N-O 3.15Å; S138-R147 PolarHBondContact O-N 2.88Å
139	H	97.6	Very high	97.3	Very high	49 Å²	49	65.1 Å²	65.1	23%	0.227	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	142.1	173.7	-56.2	-71.1	0	0	0	111.1	V104 M107 E109 V136 S146	V104-H139 PolarHBondContact O-CE1 2.85Å; M107-H139 PolarHBondContact O-CE1 3.25Å; M107-H139 PolarHBondContact O-NE2 3.19Å; E109-H139 IonicContact OE1-CD2 2.77Å; E109-H139 PolarHBondContact OE1-N 3.4Å; E109-H139 VanDerWaalsContact OE1-N 3.15Å; V136-H139 WeakPolarHBondContact CG1-CE1 3.32Å; V136-H139 VanDerWaalsContact CG1-NE2 3.32Å; V136-H139 WeakPolarHBondContact CG1-NE2 3.37Å; H139-S146 PolarHBondContact ND1-OG 2.88Å
140	N	96.8	Very high	97.3	Very high	66 Å²	66	63.9 Å²	63.9	35%	0.353	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	104.8	167	-178.4	-53.4	0	0	0	107.9	E142 T143 K144 K145	N140-E142 PolarHBondContact OD1-N 3.29Å; N140-T143 WeakPolarHBondContact CB-OG1 3.24Å; N140-T143 PolarHBondContact OD1-N 3.3Å; N140-T143 PolarHBondContact OD1-OG1 3.2Å; N140-K144 PolarHBondContact O-N 2.88Å; N140-K144 VanDerWaalsContact O-N 3.14Å; N140-K145 PolarHBondContact N-O 3.47Å; N140-K145 PolarHBondContact O-N 2.77Å
141	P	94.1	Very high	97.2	Very high	112 Å²	112	65.6 Å²	65.6	73%	0.727	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-39.3	-178.3	-24.9	35.3	0	0	0	113.6	K144	P141-K144 PolarHBondContact O-N 3.34Å
142	E	95.1	Very high	97	Very high	176 Å²	176	68 Å²	68	82%	0.822	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-50.1	-176	-61.1	175.9	174.8	0	0	111.8	N140 K144	N140-E142 PolarHBondContact OD1-N 3.29Å; E142-K144 VanDerWaalsContact C-N 3.31Å; E142-K144 PolarHBondContact O-N 3.28Å
143	T	96.1	Very high	96.8	Very high	73 Å²	73	66.4 Å²	66.4	45%	0.448	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-3.9	-178.4	61.5	0	0	0	0	113.3	N140 K145	N140-T143 WeakPolarHBondContact CB-OG1 3.24Å; N140-T143 PolarHBondContact OD1-N 3.3Å; N140-T143 PolarHBondContact OD1-OG1 3.2Å; T143-K145 PolarHBondContact O-N 2.87Å
144	K	96.6	Very high	96.6	Very high	159 Å²	159	62.7 Å²	62.7	69%	0.691	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	38.8	-174.5	-58.9	176	-177.7	171.6	0	112.3	N140 P141 E142 S160	N140-K144 PolarHBondContact O-N 2.88Å; N140-K144 VanDerWaalsContact O-N 3.14Å; P141-K144 PolarHBondContact O-N 3.34Å; E142-K144 VanDerWaalsContact C-N 3.31Å; E142-K144 PolarHBondContact O-N 3.28Å; K144-S160 VanDerWaalsContact C-OG 3.23Å; K144-S160 VanDerWaalsContact O-CB 3.3Å; K144-S160 WeakPolarHBondContact O-CB 3.45Å; K144-S160 PolarHBondContact O-N 2.86Å; K144-S160 PolarHBondContact O-OG 3.4Å
145	K	97.6	Very high	96.4	Very high	109 Å²	109	67.8 Å²	67.8	47%	0.474	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	151.9	178.4	-71.5	176.3	-175.2	178.7	0	110.9	N140 T143 V157 I158 S160	N140-K145 PolarHBondContact N-O 3.47Å; N140-K145 PolarHBondContact O-N 2.77Å; T143-K145 PolarHBondContact O-N 2.87Å; K145-V157 HydrophobicContact CB-CG1 3.76Å; K145-V157 HydrophobicContact CD-CG1 3.79Å; K145-V157 HydrophobicContact CG-CG1 4.18Å; K145-I158 CarbonylContact C-O 3.5Å; K145-I158 VanDerWaalsContact CA-O 3.25Å; K145-I158 WeakPolarHBondContact CA-O 3.18Å; K145-I158 WeakPolarHBondContact CB-O 3.5Å; K145-S160 WeakPolarHBondContact CA-OG 3.39Å; K145-S160 PolarHBondContact N-OG 3.01Å; K145-S160 PolarHBondContact O-OG 3.46Å
146	S	97.5	Very high	96.3	Very high	0 Å²	0	69 Å²	69	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.1	176.4	-61.6	0	0	0	0	109.5	S138 H139 I158 S160	S138-S146 CarbonylContact O-C 3.58Å; S138-S146 WeakPolarHBondContact O-CA 3.06Å; H139-S146 PolarHBondContact ND1-OG 2.88Å; S146-I158 PolarHBondContact N-O 3.3Å; S146-I158 VanDerWaalsContact O-CG1 3.29Å; S146-I158 WeakPolarHBondContact O-CG1 3.5Å; S146-I158 PolarHBondContact O-N 3.29Å; S146-S160 PolarHBondContact N-OG 3.46Å; S146-S160 PolarHBondContact OG-OG 3.02Å
147	R	97.7	Very high	96.3	Very high	117 Å²	117	72.6 Å²	72.6	44%	0.442	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127.4	174.5	-173.5	177	-72.1	175.2	-3.6	108.7	I137 S138 K155	I137-R147 HydrophobicContact CB-CB 4.43Å; I137-R147 HydrophobicContact CB-CG 4.34Å; I137-R147 WeakPolarHBondContact CB-O 3.24Å; I137-R147 HydrophobicContact CD1-CG 4.08Å; I137-R147 PolarHBondContact N-O 2.88Å; S138-R147 PolarHBondContact N-O 3.15Å; S138-R147 PolarHBondContact O-N 2.88Å; R147-K155 HydrophobicContact CG-CB 4.41Å
148	V	97.6	Very high	96.2	Very high	1 Å²	1	70.2 Å²	70.2	1%	0.006	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	138	-177.4	178.5	0	0	0	0	110.2	V104 I113 L116 A134 T135 K155 K156 I158	V104-V148 HydrophobicContact CG1-CG2 4.25Å; I113-V148 HydrophobicContact CD1-CG1 4.41Å; L116-V148 HydrophobicContact CD2-CB 4.45Å; L116-V148 HydrophobicContact CD2-CG1 3.93Å; L116-V148 HydrophobicContact CD2-CG2 4.5Å; A134-V148 HydrophobicContact CB-CG1 3.67Å; T135-V148 CarbonylContact O-C 3.59Å; T135-V148 WeakPolarHBondContact O-CA 3.45Å; T135-V148 WeakPolarHBondContact O-CG1 3.28Å; V148-K155 CarbonylContact O-C 3.49Å; V148-K155 WeakPolarHBondContact O-CA 3.22Å; V148-K156 PolarHBondContact N-O 3.03Å; V148-K156 PolarHBondContact O-N 3.29Å; V148-I158 HydrophobicContact CG2-CD1 3.63Å; V148-I158 HydrophobicContact CG2-CG1 3.99Å
149	K	97.5	Very high	96.2	Very high	105 Å²	105	70.1 Å²	70.1	46%	0.457	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	118.8	170	-164.5	173.9	177.8	178.5	0	109.6	A134 T135 I137	A134-K149 WeakPolarHBondContact CA-O 3.46Å; A134-K149 VanDerWaalsContact CB-O 3.27Å; A134-K149 WeakPolarHBondContact CB-O 3.25Å; T135-K149 PolarHBondContact N-O 2.86Å; T135-K149 PolarHBondContact O-N 3.28Å; I137-K149 HydrophobicContact CD1-CB 3.76Å; I137-K149 HydrophobicContact CG1-CB 4.01Å
150	L	97.5	Very high	96.2	Very high	25 Å²	25	68.8 Å²	68.8	13%	0.131	36%	0.364	C	S	.	.			trans	-79.8	161.9	176.9	-62.8	-179.5	0	0	0	111.5	L126 S152 G153 S154 K156	L126-L150 HydrophobicContact CB-CD2 4.36Å; L126-L150 HydrophobicContact CD1-CD2 4.08Å; L150-S152 PolarHBondContact O-N 3.41Å; L150-G153 WeakPolarHBondContact O-CA 3.4Å; L150-G153 PolarHBondContact O-N 2.98Å; L150-S154 WeakPolarHBondContact CB-O 3.4Å; L150-S154 PolarHBondContact N-O 3.35Å; L150-K156 HydrophobicContact CD1-CB 4.08Å; L150-K156 HydrophobicContact CD1-CD 4.19Å; L150-K156 HydrophobicContact CG-CB 4.3Å
151	P	96.2	Very high	96.2	Very high	58 Å²	58	68.5 Å²	68.5	38%	0.377	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.1	177	-11.7	13.2	0	0	0	114.4	A127 N132 Y133 G153	A127-P151 HydrophobicContact CB-CG 3.95Å; N132-P151 HydrophobicContact CB-CB 4.13Å; N132-P151 HydrophobicContact CB-CG 3.95Å; Y133-P151 WeakPolarHBondContact O-CD 3.32Å; Y133-P151 WeakPolarHBondContact O-CG 3.26Å; P151-G153 PolarHBondContact O-N 2.99Å
152	S	93.6	Very high	96.4	Very high	74 Å²	74	63.1 Å²	63.1	52%	0.517	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-12.3	172.8	43.7	0	0	0	0	113.8	L150 S154	L150-S152 PolarHBondContact O-N 3.41Å; S152-S154 VanDerWaalsContact C-N 3.32Å; S152-S154 PolarHBondContact OG-OG 2.82Å
153	G	92.3	Very high	96.5	Very high	30 Å²	30	55 Å²	55	31%	0.309	30%	0.297	S	S	.	.	S	Bend	trans	89.3	-12.8	-170	0	0	0	0	0	114.1	L150 P151	L150-G153 WeakPolarHBondContact O-CA 3.4Å; L150-G153 PolarHBondContact O-N 2.98Å; P151-G153 PolarHBondContact O-N 2.99Å
154	S	94.1	Very high	96.6	Very high	30 Å²	30	51.5 Å²	51.5	21%	0.21	28%	0.276	C	S	.	.			trans	-73.7	138.9	179	56.5	0	0	0	0	111.2	L150 S152	L150-S154 WeakPolarHBondContact CB-O 3.4Å; L150-S154 PolarHBondContact N-O 3.35Å; S152-S154 VanDerWaalsContact C-N 3.32Å; S152-S154 PolarHBondContact OG-OG 2.82Å
155	K	95.6	Very high	96.7	Very high	107 Å²	107	44 Å²	44	47%	0.465	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	142.1	171.3	-54.5	177.4	-166.3	136.7	0	109.3	I137 R147 V148 E254	I137-K155 HydrophobicContact CD1-CB 4.3Å; I137-K155 HydrophobicContact CD1-CD 3.98Å; I137-K155 HydrophobicContact CD1-CG 3.71Å; R147-K155 HydrophobicContact CG-CB 4.41Å; V148-K155 CarbonylContact O-C 3.49Å; V148-K155 WeakPolarHBondContact O-CA 3.22Å; K155-E254 WeakPolarHBondContact CE-OE1 3.45Å; K155-E254 IonicContact NZ-OE1 4Å; K155-E254 PolarHBondContact NZ-OE1 3.46Å
156	K	95.8	Very high	96.7	Very high	62 Å²	62	39.3 Å²	39.3	27%	0.27	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	135.6	174.9	-174.2	170.9	-177.7	171.1	0	109.3	E118 L126 V148 L150 I158	E118-K156 IonicContact OE1-NZ 3.61Å; E118-K156 PolarHBondContact OE1-NZ 3.48Å; L126-K156 HydrophobicContact CD1-CD 4.46Å; V148-K156 PolarHBondContact N-O 3.03Å; V148-K156 PolarHBondContact O-N 3.29Å; L150-K156 HydrophobicContact CD1-CB 4.08Å; L150-K156 HydrophobicContact CD1-CD 4.19Å; L150-K156 HydrophobicContact CG-CB 4.3Å; K156-I158 HydrophobicContact CD-CG2 4.45Å; K156-I158 HydrophobicContact CG-CG2 4.22Å
157	V	96.9	Very high	96.7	Very high	77 Å²	77	39.8 Å²	39.8	47%	0.467	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.3	171.8	-175.3	0	0	0	0	108.6	K145	K145-V157 HydrophobicContact CB-CG1 3.76Å; K145-V157 HydrophobicContact CD-CG1 3.79Å; K145-V157 HydrophobicContact CG-CG1 4.18Å
158	I	96.9	Very high	96.8	Very high	8 Å²	8	35.9 Å²	35.9	4%	0.041	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	163.2	-179.5	58.1	164.6	0	0	0	110	V104 L116 K145 S146 V148 K156 N162	V104-I158 HydrophobicContact CB-CD1 4.4Å; V104-I158 HydrophobicContact CG1-CD1 4.31Å; V104-I158 HydrophobicContact CG2-CD1 4.04Å; L116-I158 HydrophobicContact CD1-CD1 3.61Å; L116-I158 HydrophobicContact CD2-CD1 4.04Å; L116-I158 HydrophobicContact CG-CD1 4.3Å; K145-I158 CarbonylContact C-O 3.5Å; K145-I158 VanDerWaalsContact CA-O 3.25Å; K145-I158 WeakPolarHBondContact CA-O 3.18Å; K145-I158 WeakPolarHBondContact CB-O 3.5Å; S146-I158 PolarHBondContact N-O 3.3Å; S146-I158 VanDerWaalsContact O-CG1 3.29Å; S146-I158 WeakPolarHBondContact O-CG1 3.5Å; S146-I158 PolarHBondContact O-N 3.29Å; V148-I158 HydrophobicContact CG2-CD1 3.63Å; V148-I158 HydrophobicContact CG2-CG1 3.99Å; K156-I158 HydrophobicContact CD-CG2 4.45Å; K156-I158 HydrophobicContact CG-CG2 4.22Å; I158-N162 HydrophobicContact CD1-CB 4.29Å
159	A	97.6	Very high	96.8	Very high	34 Å²	34	35.9 Å²	35.9	28%	0.281	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	137.3	172.5	0	0	0	0	0	110.3	P120 A161 N162	P120-A159 HydrophobicContact CG-CB 4.16Å; A159-A161 PolarHBondContact O-N 3.4Å; A159-A161 VanDerWaalsContact O-N 3.15Å; A159-N162 VanDerWaalsContact O-CB 3.24Å; A159-N162 WeakPolarHBondContact O-CB 3.27Å; A159-N162 VanDerWaalsContact O-CG 3.31Å; A159-N162 PolarHBondContact O-N 2.75Å
160	S	97.3	Very high	96.9	Very high	21 Å²	21	31.5 Å²	31.5	15%	0.147	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.2	178.7	-65.3	0	0	0	0	113	V104 G105 K144 K145 S146 N162	V104-S160 PolarHBondContact N-O 3.04Å; G105-S160 PolarHBondContact N-O 3.18Å; K144-S160 VanDerWaalsContact C-OG 3.23Å; K144-S160 VanDerWaalsContact O-CB 3.3Å; K144-S160 WeakPolarHBondContact O-CB 3.45Å; K144-S160 PolarHBondContact O-N 2.86Å; K144-S160 PolarHBondContact O-OG 3.4Å; K145-S160 WeakPolarHBondContact CA-OG 3.39Å; K145-S160 PolarHBondContact N-OG 3.01Å; K145-S160 PolarHBondContact O-OG 3.46Å; S146-S160 PolarHBondContact N-OG 3.46Å; S146-S160 PolarHBondContact OG-OG 3.02Å; S160-N162 VanDerWaalsContact C-N 3.31Å
161	A	97	Very high	96.8	Very high	60 Å²	60	32 Å²	32	50%	0.496	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.3	174.3	0	0	0	0	0	113.9	A159	A159-A161 PolarHBondContact O-N 3.4Å; A159-A161 VanDerWaalsContact O-N 3.15Å
162	N	97.1	Very high	96.8	Very high	0 Å²	0	31 Å²	31	0%	0	21%	0.213	C	C	.	.			trans	-61	141.6	175.9	-72.5	13	0	0	0	109.9	P103 V104 E117 E118 P120 I158 A159 S160	P103-N162 CarbonylContact C-O 3.56Å; P103-N162 WeakPolarHBondContact CA-O 3.19Å; V104-N162 WeakPolarHBondContact CG2-O 3.36Å; V104-N162 PolarHBondContact N-O 2.86Å; E117-N162 HydrophobicContact CB-CB 4.02Å; E117-N162 PolarHBondContact O-ND2 3.33Å; E118-N162 PolarHBondContact O-ND2 3.48Å; P120-N162 WeakPolarHBondContact CA-OD1 3.3Å; P120-N162 WeakPolarHBondContact CD-OD1 3.45Å; P120-N162 WeakPolarHBondContact CG-OD1 3.34Å; I158-N162 HydrophobicContact CD1-CB 4.29Å; A159-N162 VanDerWaalsContact O-CB 3.24Å; A159-N162 WeakPolarHBondContact O-CB 3.27Å; A159-N162 VanDerWaalsContact O-CG 3.31Å; A159-N162 PolarHBondContact O-N 2.75Å; S160-N162 VanDerWaalsContact C-N 3.31Å
163	R	97.9	Very high	97	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.015	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	154.5	179.8	-60.4	170.2	-62.4	165.3	3.4	112.3	L29 R30 E36 V101 L102 E117	L29-R163 HydrophobicContact CD1-CB 4.31Å; R30-R163 PolarHBondContact O-NH1 3.38Å; R30-R163 VanDerWaalsContact O-NH1 3.13Å; R30-R163 PolarHBondContact O-NH2 3.4Å; E36-R163 WeakPolarHBondContact OE1-CD 3.38Å; E36-R163 IonicContact OE1-CZ 3.8Å; E36-R163 IonicContact OE1-NE 2.96Å; E36-R163 IonicContact OE1-NH1 3.73Å; E36-R163 PolarHBondContact OE1-NH1 2.72Å; E36-R163 IonicContact OE2-NH1 2.85Å; E36-R163 PolarHBondContact OE2-NH1 2.88Å; V101-R163 HydrophobicContact CG1-CB 3.94Å; L102-R163 VanDerWaalsContact O-CA 3.29Å; L102-R163 WeakPolarHBondContact O-CA 3.3Å; E117-R163 HydrophobicContact CG-CB 4.45Å; E117-R163 WeakPolarHBondContact CG-O 3.4Å; E117-R163 PolarHBondContact N-O 2.62Å; E117-R163 IonicContact OE1-CZ 3.2Å; E117-R163 IonicContact OE1-NE 3.64Å; E117-R163 PolarHBondContact OE1-NE 3.08Å; E117-R163 IonicContact OE1-NH2 2.64Å; E117-R163 PolarHBondContact OE1-NH2 3.33Å; E117-R163 PolarHBondContact OE2-N 3.49Å; E117-R163 IonicContact OE2-NE 3.3Å; E117-R163 PolarHBondContact OE2-NE 3.27Å
164	A	98.3	Very high	97.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	157.8	170.8	0	0	0	0	0	110.9	V101 L102 V104 M107 I113 L116	V101-A164 WeakPolarHBondContact CA-O 3.32Å; L102-A164 PolarHBondContact N-O 3.33Å; L102-A164 VanDerWaalsContact N-O 3.14Å; L102-A164 PolarHBondContact O-N 3.36Å; V104-A164 HydrophobicContact CG2-CB 4.21Å; M107-A164 HydrophobicContact CE-CB 4.39Å; M107-A164 WeakPolarHBondContact CE-O 3.42Å; I113-A164 HydrophobicContact CB-CB 3.84Å; I113-A164 HydrophobicContact CD1-CB 3.79Å; I113-A164 HydrophobicContact CG1-CB 4.29Å; I113-A164 HydrophobicContact CG2-CB 4.26Å; L116-A164 HydrophobicContact CB-CB 4.12Å; L116-A164 HydrophobicContact CD1-CB 3.93Å
165	V	98.4	Very high	97.3	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	133.6	169.5	177.7	0	0	0	0	107.9	L29 A79 N100 V101 I113 C114 C115	L29-V165 HydrophobicContact CD2-CG2 3.66Å; A79-V165 HydrophobicContact CB-CG1 3.98Å; N100-V165 CarbonylContact O-C 3.58Å; N100-V165 WeakPolarHBondContact O-CA 3.41Å; V101-V165 HydrophobicContact CG2-CG2 3.84Å; I113-V165 CarbonylContact C-O 3.34Å; I113-V165 VanDerWaalsContact CA-O 3.27Å; I113-V165 WeakPolarHBondContact CA-O 3.32Å; C114-V165 PolarHBondContact N-O 2.85Å; C114-V165 PolarHBondContact O-N 2.9Å; C115-V165 HydrophobicContact CB-CB 4.44Å; C115-V165 HydrophobicContact CB-CG2 3.9Å
166	V	98.4	Very high	97.4	Very high	11 Å²	11	39.8 Å²	39.8	7%	0.067	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	129.6	173.6	-179.6	0	0	0	0	109.8	L96 N97 G99 N100 L102 M107 T111	L96-V166 HydrophobicContact CG-CG2 4.48Å; N97-V166 WeakPolarHBondContact O-CB 3.42Å; G99-V166 PolarHBondContact N-O 2.85Å; N100-V166 PolarHBondContact O-N 2.68Å; L102-V166 HydrophobicContact CD1-CG2 3.57Å; M107-V166 HydrophobicContact CE-CG2 3.69Å; M107-V166 HydrophobicContact SD-CG2 4.14Å; T111-V166 HydrophobicContact CG2-CG1 4.34Å
167	G	97.9	Very high	97.5	Very high	9 Å²	9	43.9 Å²	43.9	9%	0.093	27%	0.268	C	S	.	.	S	Bend	trans	114.7	-177.4	178.2	0	0	0	0	0	114.7	I112 I113 C114	I112-G167 PolarHBondContact O-N 3.17Å; I113-G167 CarbonylContact C-O 3.52Å; I113-G167 VanDerWaalsContact C-O 3.28Å; C114-G167 WeakPolarHBondContact CB-O 3.39Å; C114-G167 PolarHBondContact N-O 2.86Å; C114-G167 PolarHBondContact SG-O 3.31Å
168	V	98.4	Very high	97.5	Very high	36 Å²	36	44.1 Å²	44.1	22%	0.218	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-93.5	146.5	178.5	-177.8	0	0	0	0	109.9	A79 E80 I112 Y133 A170	A79-V168 CarbonylContact C-O 3.44Å; A79-V168 WeakPolarHBondContact CA-O 3.19Å; E80-V168 PolarHBondContact N-O 3.33Å; I112-V168 HydrophobicContact CG2-CG2 3.7Å; Y133-V168 HydrophobicContact CD1-CG1 4.17Å; Y133-V168 HydrophobicContact CD1-CG2 4.06Å; Y133-V168 HydrophobicContact CG-CG2 4.21Å; V168-A170 PolarHBondContact O-N 3.07Å
169	V	98.6	Very high	97.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-66.6	129.4	174.4	179.7	0	0	0	0	110.9	A56 I77 C114 A127 A129 G131 N132	A56-V169 HydrophobicContact CB-CG1 3.45Å; A56-V169 VanDerWaalsContact CB-CG1 3.45Å; I77-V169 HydrophobicContact CG2-CB 4.47Å; I77-V169 HydrophobicContact CG2-CG1 3.49Å; I77-V169 VanDerWaalsContact CG2-CG1 3.49Å; I77-V169 HydrophobicContact CG2-CG2 4.25Å; C114-V169 HydrophobicContact CB-CG2 3.49Å; C114-V169 VanDerWaalsContact CB-CG2 3.49Å; A127-V169 WeakPolarHBondContact O-CG2 3.39Å; A129-V169 VanDerWaalsContact O-CB 3.26Å; A129-V169 WeakPolarHBondContact O-CB 3.34Å; A129-V169 WeakPolarHBondContact O-CG1 3.29Å; G131-V169 WeakPolarHBondContact CA-O 3.36Å; G131-V169 PolarHBondContact N-O 3.15Å; N132-V169 VanDerWaalsContact O-CG2 3.32Å; N132-V169 WeakPolarHBondContact O-CG2 3.17Å; N132-V169 PolarHBondContact O-N 2.82Å
170	A	98.3	Very high	97.5	Very high	13 Å²	13	52 Å²	52	11%	0.107	31%	0.307	C	S	.	.	S	Bend	trans	-59	157.2	178	0	0	0	0	0	113.9	P57 A78 E80 V168	P57-A170 HydrophobicContact CG-CB 3.71Å; A78-A170 HydrophobicContact CB-CB 4.44Å; A78-A170 WeakPolarHBondContact O-CB 3.43Å; A78-A170 PolarHBondContact O-N 3.17Å; E80-A170 HydrophobicContact CB-CB 4.44Å; V168-A170 PolarHBondContact O-N 3.07Å
171	G	96.5	Very high	97.5	Very high	36 Å²	36	57.9 Å²	57.9	37%	0.371	33%	0.33	S	S	.	.	S	Bend	trans	82.4	31.2	-178	0	0	0	0	0	113.7	S130	S130-G171 VanDerWaalsContact CB-O 3.28Å; S130-G171 WeakPolarHBondContact CB-O 3.28Å
172	G	96.7	Very high	97.6	Very high	37 Å²	37	58.3 Å²	58.3	38%	0.381	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	168.7	170.8	0	0	0	0	0	113.3	R174	G172-R174 PolarHBondContact O-N 3.24Å
173	G	96.3	Very high	97.7	Very high	47 Å²	47	60.1 Å²	60.1	49%	0.485	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	0.4	178	0	0	0	0	0	116.5	I175 D176	G173-I175 PolarHBondContact O-N 3.07Å; G173-D176 WeakPolarHBondContact CA-OD2 3.44Å; G173-D176 WeakPolarHBondContact O-CB 3.44Å; G173-D176 PolarHBondContact O-N 3.3Å
174	R	97.1	Very high	97.7	Very high	117 Å²	117	65.7 Å²	65.7	44%	0.442	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-17	-175.4	-162.8	-161.2	52.3	55.8	10.6	114.6	G172	G172-R174 PolarHBondContact O-N 3.24Å
175	I	96.9	Very high	97.7	Very high	132 Å²	132	66.3 Å²	66.3	68%	0.677	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-11.3	179.8	59.6	170.1	0	0	0	113.4	G173 K177	G173-I175 PolarHBondContact O-N 3.07Å; I175-K177 VanDerWaalsContact C-N 3.33Å
176	D	96.9	Very high	97.7	Very high	129 Å²	129	71.2 Å²	71.2	69%	0.69	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-35.7	-177.6	-53.7	-23.1	0	0	0	109.9	G173 P178	G173-D176 WeakPolarHBondContact CA-OD2 3.44Å; G173-D176 WeakPolarHBondContact O-CB 3.44Å; G173-D176 PolarHBondContact O-N 3.3Å; D176-P178 WeakPolarHBondContact O-CD 3.34Å
177	K	97.4	Very high	97.7	Very high	149 Å²	149	76.4 Å²	76.4	65%	0.648	42%	0.421	S	S	*	.	S	Bend	trans	-70.6	122.4	170.9	-174.2	174.6	-178.1	165.9	0	111	I175	I175-K177 VanDerWaalsContact C-N 3.33Å
178	P	97.4	Very high	97.7	Very high	81 Å²	81	79.3 Å²	79.3	53%	0.526	43%	0.431	S	S	.	.			trans	-65.8	147.4	174.2	27.4	-34.2	0	0	0	111.2	D176 L180	D176-P178 WeakPolarHBondContact O-CD 3.34Å; P178-L180 HydrophobicContact CB-CD2 3.96Å; P178-L180 HydrophobicContact CB-CG 4.25Å; P178-L180 HydrophobicContact CG-CD2 3.71Å; P178-L180 HydrophobicContact CG-CG 4.03Å; P178-L180 PolarHBondContact O-N 3Å
179	I	97.1	Very high	97.7	Very high	74 Å²	74	81.2 Å²	81.2	38%	0.379	44%	0.435	S	S	.	.			trans	-66.7	-30.9	177.6	-63.5	177.7	0	0	0	110.9	K181 R184 A185 K188	I179-K181 PolarHBondContact O-N 3.15Å; I179-R184 HydrophobicContact CG2-CB 3.68Å; I179-R184 WeakPolarHBondContact O-CD 3.26Å; I179-A185 HydrophobicContact CG2-CB 4.15Å; I179-K188 HydrophobicContact CD1-CD 4.1Å
180	L	97.7	Very high	97.6	Very high	134 Å²	134	86.9 Å²	86.9	70%	0.702	46%	0.46	S	S	*	.			trans	63.7	-63	-178.3	-58.6	174.5	0	0	0	114.6	P178	P178-L180 HydrophobicContact CB-CD2 3.96Å; P178-L180 HydrophobicContact CB-CG 4.25Å; P178-L180 HydrophobicContact CG-CD2 3.71Å; P178-L180 HydrophobicContact CG-CG 4.03Å; P178-L180 PolarHBondContact O-N 3Å
181	K	98.1	Very high	97.6	Very high	145 Å²	145	88 Å²	88	63%	0.63	47%	0.469	S	S	*	.	S	Bend	trans	-105.1	143.8	-171.1	-58.2	-172.7	-175.5	-172.8	0	112.8	I179 G183 R184 A185	I179-K181 PolarHBondContact O-N 3.15Å; K181-G183 VanDerWaalsContact C-N 3.26Å; K181-G183 PolarHBondContact O-N 2.82Å; K181-R184 PolarHBondContact O-N 2.84Å; K181-R184 VanDerWaalsContact O-N 3.11Å; K181-A185 PolarHBondContact O-N 3.05Å
182	A	98.1	Very high	97.7	Very high	68 Å²	68	89.9 Å²	89.9	56%	0.562	47%	0.467	S	S	*	.	H	α-helix	trans	-57.7	-37	172.9	0	0	0	0	0	112.4	R184 A185 Y186 W196	A182-R184 VanDerWaalsContact C-N 3.33Å; A182-R184 PolarHBondContact O-N 3.48Å; A182-A185 CarbonylContact O-C 3.38Å; A182-A185 WeakPolarHBondContact O-CA 3.34Å; A182-A185 WeakPolarHBondContact O-CB 3.45Å; A182-A185 PolarHBondContact O-N 3.47Å; A182-A185 VanDerWaalsContact O-N 3.07Å; A182-Y186 PolarHBondContact O-N 2.9Å; A182-W196 HydrophobicContact CB-CZ2 4.27Å
183	G	98.6	Very high	97.8	Very high	39 Å²	39	93.9 Å²	93.9	40%	0.402	47%	0.471	S	S	.	.	H	α-helix	trans	-59.2	-38.7	175.2	0	0	0	0	0	113.5	K181 A185 Y186 H187	K181-G183 VanDerWaalsContact C-N 3.26Å; K181-G183 PolarHBondContact O-N 2.82Å; G183-A185 VanDerWaalsContact C-N 3.34Å; G183-A185 PolarHBondContact O-N 3.25Å; G183-Y186 WeakPolarHBondContact O-CB 3.22Å; G183-Y186 PolarHBondContact O-N 3Å; G183-H187 PolarHBondContact O-CD2 3.12Å; G183-H187 PolarHBondContact O-N 3Å
184	R	98.1	Very high	97.9	Very high	120 Å²	120	95.2 Å²	95.2	45%	0.453	47%	0.466	S	S	.	.	H	α-helix	trans	-67	-36.6	174.6	-72.2	174.2	175	174.6	4.5	111.5	I179 K181 A182 K188	I179-R184 HydrophobicContact CG2-CB 3.68Å; I179-R184 WeakPolarHBondContact O-CD 3.26Å; K181-R184 PolarHBondContact O-N 2.84Å; K181-R184 VanDerWaalsContact O-N 3.11Å; A182-R184 VanDerWaalsContact C-N 3.33Å; A182-R184 PolarHBondContact O-N 3.48Å; R184-K188 WeakPolarHBondContact O-CB 3.42Å; R184-K188 PolarHBondContact O-N 2.98Å; R184-K188 VanDerWaalsContact O-N 3.07Å
185	A	98.1	Very high	97.9	Very high	13 Å²	13	90.6 Å²	90.6	11%	0.107	45%	0.452	C	S	.	.	H	α-helix	trans	-65	-43.4	172.2	0	0	0	0	0	111.5	I179 K181 A182 G183 K188 Y189 W196	I179-A185 HydrophobicContact CG2-CB 4.15Å; K181-A185 PolarHBondContact O-N 3.05Å; A182-A185 CarbonylContact O-C 3.38Å; A182-A185 WeakPolarHBondContact O-CA 3.34Å; A182-A185 WeakPolarHBondContact O-CB 3.45Å; A182-A185 PolarHBondContact O-N 3.47Å; A182-A185 VanDerWaalsContact O-N 3.07Å; G183-A185 VanDerWaalsContact C-N 3.34Å; G183-A185 PolarHBondContact O-N 3.25Å; A185-K188 WeakPolarHBondContact O-CB 3.17Å; A185-K188 PolarHBondContact O-N 2.78Å; A185-Y189 WeakPolarHBondContact O-CD2 3.44Å; A185-Y189 PolarHBondContact O-N 2.84Å; A185-W196 HydrophobicContact CB-CZ2 4.28Å
186	Y	98.4	Very high	97.9	Very high	106 Å²	106	88.3 Å²	88.3	42%	0.416	44%	0.435	S	S	.	.	H	α-helix	trans	-53.9	-55.3	174.4	170.5	-109.3	0	0	0	111.3	A182 G183 K188 Y189 K190 W196	A182-Y186 PolarHBondContact O-N 2.9Å; G183-Y186 WeakPolarHBondContact O-CB 3.22Å; G183-Y186 PolarHBondContact O-N 3Å; Y186-K188 VanDerWaalsContact C-N 3.29Å; Y186-K188 PolarHBondContact O-N 2.89Å; Y186-Y189 PolarHBondContact O-N 3.01Å; Y186-Y189 VanDerWaalsContact O-N 3.15Å; Y186-K190 HydrophobicContact CE1-CD 4.09Å; Y186-K190 WeakPolarHBondContact O-CB 3.5Å; Y186-K190 PolarHBondContact O-N 3.15Å; Y186-W196 HydrophobicContact CD2-CE3 4.16Å; Y186-W196 AromaticContact CD2-CZ3 3.74Å; Y186-W196 HydrophobicContact CD2-CZ3 3.74Å; Y186-W196 HydrophobicContact CG-CZ3 4.1Å
187	H	98.4	Very high	97.9	Very high	119 Å²	119	86.6 Å²	86.6	55%	0.551	43%	0.431	S	S	*	.	H	α-helix	trans	-60.3	-37.3	178.9	-70.8	-68.1	0	0	0	112.9	G183 Y189 K190 A191	G183-H187 PolarHBondContact O-CD2 3.12Å; G183-H187 PolarHBondContact O-N 3Å; H187-Y189 PolarHBondContact O-N 3.01Å; H187-K190 PolarHBondContact O-N 3.05Å; H187-A191 PolarHBondContact O-N 2.83Å
188	K	98.3	Very high	97.9	Very high	71 Å²	71	88.5 Å²	88.5	31%	0.309	43%	0.434	S	S	.	.	H	α-helix	trans	-60.6	-42.8	175.5	176.3	-178.2	178.2	178.9	0	112.7	I179 R184 A185 Y186 K192	I179-K188 HydrophobicContact CD1-CD 4.1Å; R184-K188 WeakPolarHBondContact O-CB 3.42Å; R184-K188 PolarHBondContact O-N 2.98Å; R184-K188 VanDerWaalsContact O-N 3.07Å; A185-K188 WeakPolarHBondContact O-CB 3.17Å; A185-K188 PolarHBondContact O-N 2.78Å; Y186-K188 VanDerWaalsContact C-N 3.29Å; Y186-K188 PolarHBondContact O-N 2.89Å; K188-K192 WeakPolarHBondContact O-CG 3.46Å
189	Y	98.3	Very high	98	Very high	76 Å²	76	88.3 Å²	88.3	30%	0.298	43%	0.431	S	S	.	.	H	α-helix	trans	-83.9	-29.1	180	-71.1	-73.4	0	0	0	112.7	A185 Y186 H187 A191 K192 R193 S195 W196	A185-Y189 WeakPolarHBondContact O-CD2 3.44Å; A185-Y189 PolarHBondContact O-N 2.84Å; Y186-Y189 PolarHBondContact O-N 3.01Å; Y186-Y189 VanDerWaalsContact O-N 3.15Å; H187-Y189 PolarHBondContact O-N 3.01Å; Y189-A191 PolarHBondContact O-N 2.81Å; Y189-K192 PolarHBondContact O-N 3.45Å; Y189-R193 PolarHBondContact O-N 3.36Å; Y189-R193 VanDerWaalsContact O-O 3.11Å; Y189-S195 WeakPolarHBondContact CD1-OG 3.47Å; Y189-W196 HydrophobicContact CD1-CB 4.22Å; Y189-W196 HydrophobicContact CD2-CB 3.29Å; Y189-W196 AromaticContact CD2-CD1 3.77Å; Y189-W196 HydrophobicContact CD2-CD2 4.33Å; Y189-W196 AromaticContact CD2-CG 3.5Å; Y189-W196 HydrophobicContact CD2-CG 3.5Å; Y189-W196 VanDerWaalsContact CD2-CG 3.5Å; Y189-W196 HydrophobicContact CE2-CB 3.88Å; Y189-W196 AromaticContact CE2-CD1 3.72Å; Y189-W196 AromaticContact CE2-CG 3.92Å; Y189-W196 HydrophobicContact CE2-CG 3.92Å; Y189-W196 HydrophobicContact CG-CB 3.5Å; Y189-W196 VanDerWaalsContact CG-CB 3.5Å; Y189-W196 HydrophobicContact CG-CG 4.21Å
190	K	98.1	Very high	98	Very high	119 Å²	119	92.6 Å²	92.6	52%	0.517	44%	0.443	S	S	.	.	H	α-helix	trans	-55.2	-38.5	173.3	-170.9	-176.6	-178.3	-171	0	111.7	H19 Y186 H187 K192	H19-K190 PolarHBondContact ND1-O 2.82Å; Y186-K190 HydrophobicContact CE1-CD 4.09Å; Y186-K190 WeakPolarHBondContact O-CB 3.5Å; Y186-K190 PolarHBondContact O-N 3.15Å; H187-K190 PolarHBondContact O-N 3.05Å; K190-K192 VanDerWaalsContact C-N 3.28Å; K190-K192 PolarHBondContact O-N 3.34Å
191	A	97.9	Very high	98	Very high	37 Å²	37	86.8 Å²	86.8	31%	0.306	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-6.5	175.8	0	0	0	0	0	114.6	H187 Y189	H187-A191 PolarHBondContact O-N 2.83Å; Y189-A191 PolarHBondContact O-N 2.81Å
192	K	98.4	Very high	98	Very high	74 Å²	74	81.2 Å²	81.2	32%	0.322	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-69	-173.4	-67.1	-178	-176.1	-123.5	0	112.5	H19 G53 K188 Y189 K190	H19-K192 PolarHBondContact N-O 3.43Å; G53-K192 VanDerWaalsContact O-CE 3.24Å; G53-K192 WeakPolarHBondContact O-CE 2.72Å; G53-K192 PolarHBondContact O-NZ 3.15Å; G53-K192 VanDerWaalsContact O-NZ 3.15Å; K188-K192 WeakPolarHBondContact O-CG 3.46Å; Y189-K192 PolarHBondContact O-N 3.45Å; K190-K192 VanDerWaalsContact C-N 3.28Å; K190-K192 PolarHBondContact O-N 3.34Å
193	R	98.1	Very high	98	Very high	122 Å²	122	80.4 Å²	80.4	46%	0.46	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-175.6	163.8	-178.7	58.3	178.1	154.8	121.4	-2.7	109.9	K17 Y189 S195	K17-R193 WeakPolarHBondContact O-CB 3.37Å; Y189-R193 PolarHBondContact O-N 3.36Å; Y189-R193 VanDerWaalsContact O-O 3.11Å; R193-S195 PolarHBondContact O-N 2.74Å
194	N	98	Very high	97.9	Very high	74 Å²	74	80.3 Å²	80.3	40%	0.396	38%	0.376	S	S	.	.	S	Bend	trans	-68.1	88.4	171.7	-168.3	-9	0	0	0	111.9	V15 F16	V15-N194 WeakPolarHBondContact O-CB 3.4Å; F16-N194 VanDerWaalsContact CD1-O 3.28Å; F16-N194 WeakPolarHBondContact CD1-O 3.25Å
195	S	96.6	Very high	97.9	Very high	21 Å²	21	79.5 Å²	79.5	15%	0.147	38%	0.381	C	S	.	.			trans	-137.2	6.8	175.7	63.7	0	0	0	0	114.5	Y189 R193 R198	Y189-S195 WeakPolarHBondContact CD1-OG 3.47Å; R193-S195 PolarHBondContact O-N 2.74Å; S195-R198 WeakPolarHBondContact O-CG 3.1Å
196	W	98.1	Very high	97.8	Very high	83 Å²	83	83.4 Å²	83.4	31%	0.314	41%	0.405	S	S	.	.			trans	-140	139	178.1	-179.5	94.7	0	0	0	107.5	A182 A185 Y186 Y189	A182-W196 HydrophobicContact CB-CZ2 4.27Å; A185-W196 HydrophobicContact CB-CZ2 4.28Å; Y186-W196 HydrophobicContact CD2-CE3 4.16Å; Y186-W196 AromaticContact CD2-CZ3 3.74Å; Y186-W196 HydrophobicContact CD2-CZ3 3.74Å; Y186-W196 HydrophobicContact CG-CZ3 4.1Å; Y189-W196 HydrophobicContact CD1-CB 4.22Å; Y189-W196 HydrophobicContact CD2-CB 3.29Å; Y189-W196 AromaticContact CD2-CD1 3.77Å; Y189-W196 HydrophobicContact CD2-CD2 4.33Å; Y189-W196 AromaticContact CD2-CG 3.5Å; Y189-W196 HydrophobicContact CD2-CG 3.5Å; Y189-W196 VanDerWaalsContact CD2-CG 3.5Å; Y189-W196 HydrophobicContact CE2-CB 3.88Å; Y189-W196 AromaticContact CE2-CD1 3.72Å; Y189-W196 AromaticContact CE2-CG 3.92Å; Y189-W196 HydrophobicContact CE2-CG 3.92Å; Y189-W196 HydrophobicContact CG-CB 3.5Å; Y189-W196 VanDerWaalsContact CG-CB 3.5Å; Y189-W196 HydrophobicContact CG-CG 4.21Å
197	P	97.9	Very high	97.8	Very high	94 Å²	94	80.7 Å²	80.7	61%	0.61	40%	0.399	S	S	*	.	S	Bend	cis	-73.7	165	3.3	30.1	-35.6	0	0	0	114.2
198	R	97.4	Very high	97.7	Very high	188 Å²	188	77.1 Å²	77.1	71%	0.709	38%	0.383	S	S	*	.			trans	-115.4	100.5	177.8	-70.5	-178.8	66.7	-165.2	0.3	110.9	S195	S195-R198 WeakPolarHBondContact O-CG 3.1Å
199	V	98	Very high	97.7	Very high	77 Å²	77	75.1 Å²	75.1	47%	0.467	38%	0.375	S	S	.	.			trans	-64.2	134.9	167.4	-174.5	0	0	0	0	109.9	R6 A203 M204	R6-V199 PolarHBondContact NH1-O 2.77Å; R6-V199 PolarHBondContact NH2-O 3.48Å; R6-V199 VanDerWaalsContact NH2-O 3.16Å; V199-A203 HydrophobicContact CG1-CB 4.46Å; V199-M204 HydrophobicContact CB-CE 3.6Å; V199-M204 HydrophobicContact CG1-CE 3.62Å; V199-M204 HydrophobicContact CG1-CG 4.19Å
200	R	97.9	Very high	97.6	Very high	165 Å²	165	72.7 Å²	72.7	62%	0.623	37%	0.368	S	S	*	.			trans	-73.3	145.9	177	-61.2	-174.4	-64.1	179	3	109.8	V202 A203	R200-V202 VanDerWaalsContact C-N 3.32Å; R200-V202 HydrophobicContact CB-CG2 4.27Å; R200-V202 PolarHBondContact O-N 3.07Å; R200-A203 PolarHBondContact O-N 3.3Å
201	G	97.1	Very high	97.6	Very high	12 Å²	12	68.2 Å²	68.2	12%	0.124	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-64.5	-33.3	-177.1	0	0	0	0	0	114.2	A203 M204 G212	G201-A203 PolarHBondContact O-N 3.36Å; G201-M204 WeakPolarHBondContact O-CB 3.02Å; G201-M204 PolarHBondContact O-N 3.11Å; G201-G212 WeakPolarHBondContact O-CA 3.17Å
202	V	98.1	Very high	97.5	Very high	28 Å²	28	67.1 Å²	67.1	17%	0.17	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-71.2	-13	177.4	-62.5	0	0	0	0	114.2	R200 F211 I219	R200-V202 VanDerWaalsContact C-N 3.32Å; R200-V202 HydrophobicContact CB-CG2 4.27Å; R200-V202 PolarHBondContact O-N 3.07Å; V202-F211 WeakPolarHBondContact CA-O 3.09Å; V202-F211 HydrophobicContact CG1-CB 4.08Å; V202-I219 HydrophobicContact CG1-CG1 3.9Å
203	A	97.7	Very high	97.4	Very high	50 Å²	50	64.6 Å²	64.6	41%	0.413	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-98.9	15.5	177.3	0	0	0	0	0	111.9	V199 R200 G201	V199-A203 HydrophobicContact CG1-CB 4.46Å; R200-A203 PolarHBondContact O-N 3.3Å; G201-A203 PolarHBondContact O-N 3.36Å
204	M	97.9	Very high	97.3	Very high	37 Å²	37	61.8 Å²	61.8	18%	0.182	35%	0.345	C	S	.	.	S	Bend	trans	-111.4	165.9	178.3	-61	-179	177.1	0	0	109.6	V199 G201 E208 H209 G212 G213	V199-M204 HydrophobicContact CB-CE 3.6Å; V199-M204 HydrophobicContact CG1-CE 3.62Å; V199-M204 HydrophobicContact CG1-CG 4.19Å; G201-M204 WeakPolarHBondContact O-CB 3.02Å; G201-M204 PolarHBondContact O-N 3.11Å; M204-E208 HydrophobicContact CB-CB 4.34Å; M204-E208 HydrophobicContact SD-CB 4.35Å; M204-H209 HydrophobicContact CB-CB 4.13Å; M204-H209 HydrophobicContact SD-CB 3.82Å; M204-G212 CarbonylContact O-C 3.49Å; M204-G212 WeakPolarHBondContact O-CA 3.46Å; M204-G213 PolarHBondContact O-N 3.31Å
205	N	97.8	Very high	97.3	Very high	104 Å²	104	66.3 Å²	66.3	56%	0.556	37%	0.369	S	S	*	.			trans	-76	161.2	170.7	-53.3	-41.3	0	0	0	109.2	V207 E208 H209	N205-V207 HydrophobicContact CB-CG1 4.21Å; N205-V207 PolarHBondContact O-N 2.91Å; N205-V207 VanDerWaalsContact O-N 3.09Å; N205-E208 WeakPolarHBondContact CA-OE2 3.14Å; N205-E208 WeakPolarHBondContact CB-OE2 3.41Å; N205-E208 PolarHBondContact N-OE2 3.16Å; N205-E208 VanDerWaalsContact N-OE2 3.13Å; N205-E208 PolarHBondContact O-N 3.13Å; N205-E208 VanDerWaalsContact O-N 3.15Å; N205-H209 PolarHBondContact O-N 2.95Å
206	P	96.3	Very high	97.3	Very high	95 Å²	95	72.3 Å²	72.3	62%	0.617	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-19.9	-175.8	23.9	-31.6	0	0	0	112.6	G212	P206-G212 WeakPolarHBondContact CA-O 3.36Å; P206-G212 WeakPolarHBondContact CB-O 3.07Å
207	V	97.4	Very high	97.3	Very high	49 Å²	49	74.5 Å²	74.5	30%	0.297	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-30.1	178.3	71.6	0	0	0	0	112.9	R3 N205	R3-V207 HydrophobicContact CB-CG2 3.99Å; R3-V207 WeakPolarHBondContact CB-O 3.43Å; R3-V207 HydrophobicContact CG-CG2 3.73Å; R3-V207 PolarHBondContact N-O 3.01Å; N205-V207 HydrophobicContact CB-CG1 4.21Å; N205-V207 PolarHBondContact O-N 2.91Å; N205-V207 VanDerWaalsContact O-N 3.09Å
208	E	97.1	Very high	97.3	Very high	44 Å²	44	75 Å²	75	21%	0.206	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-20.2	-179.3	-62	87.5	-166.1	0	0	114.9	R3 I5 M204 N205	R3-E208 IonicContact NH1-OE1 3.22Å; R3-E208 PolarHBondContact NH1-OE1 2.81Å; I5-E208 VanDerWaalsContact CG2-O 3.26Å; I5-E208 WeakPolarHBondContact CG2-O 3.17Å; M204-E208 HydrophobicContact CB-CB 4.34Å; M204-E208 HydrophobicContact SD-CB 4.35Å; N205-E208 WeakPolarHBondContact CA-OE2 3.14Å; N205-E208 WeakPolarHBondContact CB-OE2 3.41Å; N205-E208 PolarHBondContact N-OE2 3.16Å; N205-E208 VanDerWaalsContact N-OE2 3.13Å; N205-E208 PolarHBondContact O-N 3.13Å; N205-E208 VanDerWaalsContact O-N 3.15Å
209	H	97.5	Very high	97.3	Very high	29 Å²	29	69.3 Å²	69.3	13%	0.134	39%	0.385	C	S	.	.			trans	-149.5	140.2	-178.8	-160.8	-82	0	0	0	112.4	M204 N205 F211 G212	M204-H209 HydrophobicContact CB-CB 4.13Å; M204-H209 HydrophobicContact SD-CB 3.82Å; N205-H209 PolarHBondContact O-N 2.95Å; H209-F211 AromaticContact CE1-CD2 3.38Å; H209-F211 WeakPolarHBondContact CE1-CD2 3.49Å; H209-F211 AromaticContact CE1-CE2 3.99Å; H209-F211 AromaticContact CE1-CG 3.8Å; H209-F211 AromaticContact ND1-CD2 3.76Å; H209-F211 AromaticContact ND1-CG 3.71Å; H209-F211 PolarHBondContact ND1-N 3.17Å; H209-F211 VanDerWaalsContact ND1-N 3.17Å; H209-F211 PolarHBondContact O-N 3.09Å; H209-G212 PolarHBondContact O-N 3.46Å
210	P	96.9	Very high	97.1	Very high	24 Å²	24	68.8 Å²	68.8	16%	0.156	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-6.2	176.2	-27.7	35.4	0	0	0	116.8	K221 G232 V235	P210-K221 WeakPolarHBondContact O-CE 3.44Å; P210-K221 PolarHBondContact O-NZ 3.29Å; P210-G232 VanDerWaalsContact CG-O 3.22Å; P210-G232 WeakPolarHBondContact CG-O 3.39Å; P210-V235 HydrophobicContact CB-CG2 3.89Å; P210-V235 HydrophobicContact CG-CG1 4.5Å; P210-V235 HydrophobicContact CG-CG2 3.68Å
211	F	97.6	Very high	97	Very high	25 Å²	25	64.4 Å²	64.4	11%	0.11	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	3.8	-179.6	-56.9	-30.8	0	0	0	111.7	V202 H209 I219 K221 V235	V202-F211 WeakPolarHBondContact CA-O 3.09Å; V202-F211 HydrophobicContact CG1-CB 4.08Å; H209-F211 AromaticContact CE1-CD2 3.38Å; H209-F211 WeakPolarHBondContact CE1-CD2 3.49Å; H209-F211 AromaticContact CE1-CE2 3.99Å; H209-F211 AromaticContact CE1-CG 3.8Å; H209-F211 AromaticContact ND1-CD2 3.76Å; H209-F211 AromaticContact ND1-CG 3.71Å; H209-F211 PolarHBondContact ND1-N 3.17Å; H209-F211 VanDerWaalsContact ND1-N 3.17Å; H209-F211 PolarHBondContact O-N 3.09Å; F211-I219 HydrophobicContact CB-CG2 4.34Å; F211-I219 HydrophobicContact CD1-CG2 3.38Å; F211-I219 HydrophobicContact CD2-CG2 4.11Å; F211-I219 HydrophobicContact CE1-CG2 3.52Å; F211-I219 HydrophobicContact CE2-CG2 4.24Å; F211-I219 HydrophobicContact CG-CG2 3.72Å; F211-I219 HydrophobicContact CZ-CG2 3.97Å; F211-K221 HydrophobicContact CD1-CD 4.27Å; F211-K221 HydrophobicContact CD1-CG 4.2Å; F211-K221 HydrophobicContact CE1-CD 4.11Å; F211-K221 HydrophobicContact CE1-CG 3.89Å; F211-V235 HydrophobicContact CE1-CG2 4.35Å; F211-V235 HydrophobicContact CE2-CG2 4.09Å; F211-V235 HydrophobicContact CZ-CG2 3.95Å
212	G	96.4	Very high	97	Very high	14 Å²	14	69 Å²	69	14%	0.144	41%	0.408	C	S	.	.			trans	-84.5	164.3	-179.2	0	0	0	0	0	112.5	G201 M204 P206 H209	G201-G212 WeakPolarHBondContact O-CA 3.17Å; M204-G212 CarbonylContact O-C 3.49Å; M204-G212 WeakPolarHBondContact O-CA 3.46Å; P206-G212 WeakPolarHBondContact CA-O 3.36Å; P206-G212 WeakPolarHBondContact CB-O 3.07Å; H209-G212 PolarHBondContact O-N 3.46Å
213	G	96.6	Very high	96.9	Very high	22 Å²	22	69.6 Å²	69.6	23%	0.227	41%	0.414	C	S	.	.			trans	89.3	-174.6	179.8	0	0	0	0	0	115.4	M204	M204-G213 PolarHBondContact O-N 3.31Å
214	G	96.2	Very high	96.9	Very high	62 Å²	62	70.4 Å²	70.4	64%	0.639	41%	0.414	S	S	*	.	S	Bend	trans	82.1	161.7	-174.1	0	0	0	0	0	113.3	H216	G214-H216 VanDerWaalsContact C-N 3.31Å
215	N	97.3	Very high	96.9	Very high	170 Å²	170	70.1 Å²	70.1	91%	0.909	41%	0.413	S	S	*	.	S	Bend	trans	-72.5	-27	179.1	-64.2	-13.6	0	0	0	112.2
216	H	97.3	Very high	96.8	Very high	147 Å²	147	73 Å²	73	68%	0.681	42%	0.416	S	S	*	.	S	Bend	trans	-114.3	142.9	176.3	-64.8	94.7	0	0	0	110.6	G214 H218	G214-H216 VanDerWaalsContact C-N 3.31Å; H216-H218 PolarHBondContact O-N 2.95Å; H216-H218 PolarHBondContact O-ND1 3.45Å
217	Q	97.6	Very high	96.9	Very high	128 Å²	128	76.6 Å²	76.6	60%	0.598	42%	0.417	S	S	*	.			trans	-73.2	90.9	175.2	-67.9	-174	13.4	0	0	111.1
218	H	97.2	Very high	96.9	Very high	106 Å²	106	79.2 Å²	79.2	49%	0.491	43%	0.43	S	S	.	.			trans	-139.1	162.8	177.3	71.6	-65.4	0	0	0	110.4	H216 G220	H216-H218 PolarHBondContact O-N 2.95Å; H216-H218 PolarHBondContact O-ND1 3.45Å; H218-G220 PolarHBondContact CD2-N 2.85Å
219	I	97	Very high	96.9	Very high	68 Å²	68	77.3 Å²	77.3	35%	0.349	42%	0.421	S	S	.	.			trans	-78.9	-29.9	-176.1	-56.6	-178.2	0	0	0	111.6	V202 F211 K221	V202-I219 HydrophobicContact CG1-CG1 3.9Å; F211-I219 HydrophobicContact CB-CG2 4.34Å; F211-I219 HydrophobicContact CD1-CG2 3.38Å; F211-I219 HydrophobicContact CD2-CG2 4.11Å; F211-I219 HydrophobicContact CE1-CG2 3.52Å; F211-I219 HydrophobicContact CE2-CG2 4.24Å; F211-I219 HydrophobicContact CG-CG2 3.72Å; F211-I219 HydrophobicContact CZ-CG2 3.97Å; I219-K221 WeakPolarHBondContact CG2-O 3.44Å; I219-K221 PolarHBondContact O-N 2.79Å
220	G	95.1	Very high	96.9	Very high	66 Å²	66	80 Å²	80	68%	0.68	44%	0.441	S	S	*	.			trans	72.9	-40.7	-177.5	0	0	0	0	0	114.6	H218	H218-G220 PolarHBondContact CD2-N 2.85Å
221	K	94.4	Very high	96.8	Very high	73 Å²	73	82.5 Å²	82.5	32%	0.317	46%	0.464	S	S	.	.	S	Bend	trans	-116.1	160.6	179.1	70.8	-157.8	73.2	176.9	0	112.3	P210 F211 I219 S223	P210-K221 WeakPolarHBondContact O-CE 3.44Å; P210-K221 PolarHBondContact O-NZ 3.29Å; F211-K221 HydrophobicContact CD1-CD 4.27Å; F211-K221 HydrophobicContact CD1-CG 4.2Å; F211-K221 HydrophobicContact CE1-CD 4.11Å; F211-K221 HydrophobicContact CE1-CG 3.89Å; I219-K221 WeakPolarHBondContact CG2-O 3.44Å; I219-K221 PolarHBondContact O-N 2.79Å; K221-S223 PolarHBondContact O-N 2.76Å
222	P	96.8	Very high	96.7	Very high	108 Å²	108	82 Å²	82	70%	0.701	47%	0.466	S	S	*	.			trans	-52.5	132.7	171	-27.4	35.7	0	0	0	111.7	T224	P222-T224 VanDerWaalsContact C-N 3.28Å; P222-T224 PolarHBondContact O-N 3.32Å
223	S	97.1	Very high	96.7	Very high	40 Å²	40	87.4 Å²	87.4	28%	0.28	48%	0.482	S	S	.	.	S	Bend	trans	-80.3	-9.7	-177.1	67.3	0	0	0	0	113.6	K221 L237	K221-S223 PolarHBondContact O-N 2.76Å; S223-L237 PolarHBondContact O-N 3.31Å
224	T	97.5	Very high	96.7	Very high	68 Å²	68	90.1 Å²	90.1	42%	0.417	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	134.9	173.5	48.2	0	0	0	0	110.4	P222 L237 A240 T243	P222-T224 VanDerWaalsContact C-N 3.28Å; P222-T224 PolarHBondContact O-N 3.32Å; T224-L237 WeakPolarHBondContact CA-O 3.1Å; T224-L237 HydrophobicContact CG2-CB 4.08Å; T224-L237 HydrophobicContact CG2-CD1 4.22Å; T224-A240 HydrophobicContact CG2-CB 4.19Å; T224-T243 HydrophobicContact CG2-CG2 3.55Å
225	I	97.3	Very high	96.7	Very high	31 Å²	31	88.1 Å²	88.1	16%	0.159	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	142.8	-178.8	-166.5	157.2	0	0	0	112.8	A229 R233 K234 L237 I238 A239	I225-A229 HydrophobicContact CD1-CB 3.65Å; I225-A229 HydrophobicContact CG1-CB 3.67Å; I225-R233 HydrophobicContact CD1-CG 3.9Å; I225-R233 WeakPolarHBondContact CD1-O 3.49Å; I225-K234 HydrophobicContact CG2-CG 4.38Å; I225-L237 PolarHBondContact N-O 3.34Å; I225-I238 HydrophobicContact CG2-CB 4.4Å; I225-I238 HydrophobicContact CG2-CG1 4.09Å; I225-A239 WeakPolarHBondContact O-CA 3.38Å; I225-A239 PolarHBondContact O-N 3.39Å
226	R	97.1	Very high	96.7	Very high	165 Å²	165	82.1 Å²	82.1	62%	0.623	44%	0.442	S	S	*	.			trans	-61.4	152.1	176.9	66	178.5	-178.9	158.4	-14	112.8	D228 A229	R226-D228 VanDerWaalsContact C-N 3.34Å; R226-D228 WeakPolarHBondContact CB-OD1 3.09Å; R226-D228 WeakPolarHBondContact CD-OD1 3.44Å; R226-D228 WeakPolarHBondContact CD-OD2 3.49Å; R226-D228 WeakPolarHBondContact CG-OD1 3.41Å; R226-D228 IonicContact CZ-OD2 3.52Å; R226-D228 IonicContact NE-OD1 2.79Å; R226-D228 IonicContact NE-OD2 2.74Å; R226-D228 IonicContact NH1-OD2 3.83Å; R226-D228 PolarHBondContact NH1-OD2 3.22Å; R226-D228 PolarHBondContact O-N 3.05Å; R226-A229 HydrophobicContact CG-CB 4.1Å; R226-A229 WeakPolarHBondContact O-CB 3.44Å; R226-A229 PolarHBondContact O-N 3.19Å
227	R	96.9	Very high	96.7	Very high	169 Å²	169	79 Å²	79	64%	0.638	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-34.9	-173	-178.4	174.7	-68.9	166.2	2.4	112.9	A229 K234 A239	R227-A229 VanDerWaalsContact C-N 3.32Å; R227-K234 WeakPolarHBondContact O-CE 3.13Å; R227-K234 PolarHBondContact O-NZ 2.84Å; R227-A239 HydrophobicContact CB-CB 4.04Å
228	D	97.2	Very high	96.7	Very high	105 Å²	105	77.3 Å²	77.3	56%	0.561	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-2.5	-178.5	58.8	-43.1	0	0	0	113.6	R226	R226-D228 VanDerWaalsContact C-N 3.34Å; R226-D228 WeakPolarHBondContact CB-OD1 3.09Å; R226-D228 WeakPolarHBondContact CD-OD1 3.44Å; R226-D228 WeakPolarHBondContact CD-OD2 3.49Å; R226-D228 WeakPolarHBondContact CG-OD1 3.41Å; R226-D228 IonicContact CZ-OD2 3.52Å; R226-D228 IonicContact NE-OD1 2.79Å; R226-D228 IonicContact NE-OD2 2.74Å; R226-D228 IonicContact NH1-OD2 3.83Å; R226-D228 PolarHBondContact NH1-OD2 3.22Å; R226-D228 PolarHBondContact O-N 3.05Å
229	A	97.1	Very high	96.7	Very high	4 Å²	4	73.9 Å²	73.9	3%	0.033	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-54.7	145.8	176.9	0	0	0	0	0	112.2	I225 R226 R227 K234	I225-A229 HydrophobicContact CD1-CB 3.65Å; I225-A229 HydrophobicContact CG1-CB 3.67Å; R226-A229 HydrophobicContact CG-CB 4.1Å; R226-A229 WeakPolarHBondContact O-CB 3.44Å; R226-A229 PolarHBondContact O-N 3.19Å; R227-A229 VanDerWaalsContact C-N 3.32Å; A229-K234 HydrophobicContact CB-CB 4.13Å; A229-K234 HydrophobicContact CB-CG 4.41Å; A229-K234 WeakPolarHBondContact O-CE 2.96Å; A229-K234 PolarHBondContact O-NZ 3.38Å; A229-K234 VanDerWaalsContact O-NZ 3.17Å
230	P	97.4	Very high	96.6	Very high	84 Å²	84	72.6 Å²	72.6	55%	0.545	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-67.7	158.7	-179	26.2	-33.5	0	0	0	112.1	R233 K234	P230-R233 HydrophobicContact CG-CB 3.91Å; P230-R233 PolarHBondContact O-N 3.13Å; P230-R233 VanDerWaalsContact O-N 3.12Å; P230-K234 PolarHBondContact O-N 2.79Å
231	A	96.7	Very high	96.4	Very high	77 Å²	77	78.7 Å²	78.7	64%	0.636	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	140.8	170	0	0	0	0	0	109.8	Q8 R233	Q8-A231 HydrophobicContact CG-CB 4.16Å; Q8-A231 VanDerWaalsContact NE2-C 3.29Å; Q8-A231 PolarHBondContact NE2-O 3.02Å; A231-R233 PolarHBondContact O-N 3.22Å
232	G	94.8	Very high	96.3	Very high	16 Å²	16	83.5 Å²	83.5	17%	0.165	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-34.3	-172.8	0	0	0	0	0	113.5	P210	P210-G232 VanDerWaalsContact CG-O 3.22Å; P210-G232 WeakPolarHBondContact CG-O 3.39Å
233	R	95.6	Very high	96.1	Very high	126 Å²	126	82.5 Å²	82.5	48%	0.475	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-33.8	171.8	-167.2	64.6	180	-152.5	-5.7	112.9	I225 P230 A231 V235	I225-R233 HydrophobicContact CD1-CG 3.9Å; I225-R233 WeakPolarHBondContact CD1-O 3.49Å; P230-R233 HydrophobicContact CG-CB 3.91Å; P230-R233 PolarHBondContact O-N 3.13Å; P230-R233 VanDerWaalsContact O-N 3.12Å; A231-R233 PolarHBondContact O-N 3.22Å; R233-V235 VanDerWaalsContact C-N 3.25Å; R233-V235 PolarHBondContact O-N 2.93Å
234	K	97.5	Very high	96	Very high	80 Å²	80	84.2 Å²	84.2	35%	0.348	45%	0.448	S	S	.	.			trans	-66.9	72.6	179.5	-162.7	-178.7	-51.9	-177.3	0	113	I225 R227 A229 P230 I238	I225-K234 HydrophobicContact CG2-CG 4.38Å; R227-K234 WeakPolarHBondContact O-CE 3.13Å; R227-K234 PolarHBondContact O-NZ 2.84Å; A229-K234 HydrophobicContact CB-CB 4.13Å; A229-K234 HydrophobicContact CB-CG 4.41Å; A229-K234 WeakPolarHBondContact O-CE 2.96Å; A229-K234 PolarHBondContact O-NZ 3.38Å; A229-K234 VanDerWaalsContact O-NZ 3.17Å; P230-K234 PolarHBondContact O-N 2.79Å; K234-I238 HydrophobicContact CD-CD1 4.42Å; K234-I238 HydrophobicContact CD-CG2 3.97Å; K234-I238 HydrophobicContact CG-CD1 3.99Å; K234-I238 HydrophobicContact CG-CG1 4.02Å; K234-I238 HydrophobicContact CG-CG2 3.94Å
235	V	96.8	Very high	95.8	Very high	19 Å²	19	90.5 Å²	90.5	12%	0.115	46%	0.464	C	S	.	.			trans	-129.9	156.5	179	-58.8	0	0	0	0	110.5	I5 P210 F211 R233	I5-V235 HydrophobicContact CD1-CG1 3.41Å; I5-V235 VanDerWaalsContact CD1-CG1 3.41Å; P210-V235 HydrophobicContact CB-CG2 3.89Å; P210-V235 HydrophobicContact CG-CG1 4.5Å; P210-V235 HydrophobicContact CG-CG2 3.68Å; F211-V235 HydrophobicContact CE1-CG2 4.35Å; F211-V235 HydrophobicContact CE2-CG2 4.09Å; F211-V235 HydrophobicContact CZ-CG2 3.95Å; R233-V235 VanDerWaalsContact C-N 3.25Å; R233-V235 PolarHBondContact O-N 2.93Å
236	G	96.3	Very high	95.6	Very high	45 Å²	45	93.4 Å²	93.4	46%	0.464	48%	0.48	S	S	.	.	S	Bend	trans	92.9	-139.7	-176.2	0	0	0	0	0	112.8	I238	G236-I238 PolarHBondContact O-N 3.21Å
237	L	97.5	Very high	95.3	Very high	81 Å²	81	93.6 Å²	93.6	42%	0.424	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	88.2	179.9	-61	-179.6	0	0	0	109.8	S223 T224 I225 A239 A240 T243	S223-L237 PolarHBondContact O-N 3.31Å; T224-L237 WeakPolarHBondContact CA-O 3.1Å; T224-L237 HydrophobicContact CG2-CB 4.08Å; T224-L237 HydrophobicContact CG2-CD1 4.22Å; I225-L237 PolarHBondContact N-O 3.34Å; L237-A239 PolarHBondContact O-N 2.75Å; L237-A240 HydrophobicContact CB-CB 3.95Å; L237-T243 HydrophobicContact CD1-CG2 3.8Å
238	I	97.6	Very high	94.9	Very high	92 Å²	92	88.9 Å²	88.9	47%	0.472	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	118.4	-174.9	-56	170.7	0	0	0	110.5	I225 K234 G236 A240	I225-I238 HydrophobicContact CG2-CB 4.4Å; I225-I238 HydrophobicContact CG2-CG1 4.09Å; K234-I238 HydrophobicContact CD-CD1 4.42Å; K234-I238 HydrophobicContact CD-CG2 3.97Å; K234-I238 HydrophobicContact CG-CD1 3.99Å; K234-I238 HydrophobicContact CG-CG1 4.02Å; K234-I238 HydrophobicContact CG-CG2 3.94Å; G236-I238 PolarHBondContact O-N 3.21Å; I238-A240 PolarHBondContact O-N 3.33Å
239	A	96.3	Very high	94.3	Very high	35 Å²	35	89.8 Å²	89.8	29%	0.289	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	40.1	177.8	0	0	0	0	0	112.9	I225 R227 L237 R241	I225-A239 WeakPolarHBondContact O-CA 3.38Å; I225-A239 PolarHBondContact O-N 3.39Å; R227-A239 HydrophobicContact CB-CB 4.04Å; L237-A239 PolarHBondContact O-N 2.75Å; A239-R241 PolarHBondContact O-N 2.88Å
240	A	94.8	Very high	93.3	Very high	41 Å²	41	97 Å²	97	34%	0.339	52%	0.524	S	S	.	.			trans	-66.4	117.4	179.6	0	0	0	0	0	110.3	T224 L237 I238 R242 T243	T224-A240 HydrophobicContact CG2-CB 4.19Å; L237-A240 HydrophobicContact CB-CB 3.95Å; I238-A240 PolarHBondContact O-N 3.33Å; A240-R242 VanDerWaalsContact C-N 3.33Å; A240-T243 HydrophobicContact CB-CG2 4.1Å
241	R	91.6	Very high	92.2	Very high	194 Å²	194	98.9 Å²	98.9	73%	0.732	54%	0.535	S	S	*	.	S	Bend	trans	-75.7	-24.8	172.5	-66.6	179.2	171.2	175.3	-6.5	112.7	A239 T253	A239-R241 PolarHBondContact O-N 2.88Å; R241-T253 PolarHBondContact NH1-OG1 3.37Å
242	R	91.3	Very high	91.2	Very high	174 Å²	174	98.1 Å²	98.1	66%	0.657	52%	0.522	S	S	*	.			trans	-145.4	142.3	179	-165.7	-179.8	-146	-179.7	6.6	108.7	A240	A240-R242 VanDerWaalsContact C-N 3.33Å
243	T	94.3	Very high	89.7	Confident	87 Å²	87	101.2 Å²	101.2	53%	0.534	54%	0.537	S	S	.	.			trans	-122.4	171.8	173.8	57.9	0	0	0	0	110.3	T224 L237 A240	T224-T243 HydrophobicContact CG2-CG2 3.55Å; L237-T243 HydrophobicContact CD1-CG2 3.8Å; A240-T243 HydrophobicContact CB-CG2 4.1Å
244	G	93.9	Very high	87.8	Confident	76 Å²	76	100.8 Å²	100.8	78%	0.784	54%	0.541	S	S	*	.	S	Bend	trans	84.4	-173.6	-179	0	0	0	0	0	114.4	L246	G244-L246 PolarHBondContact O-N 3.26Å
245	R	94.1	Very high	85.5	Confident	200 Å²	200	105.4 Å²	105.4	76%	0.755	56%	0.561	S	S	*	*	S	Bend	trans	-72.4	125.1	179.3	-177.1	175.2	179.7	174.2	0.7	109.5	R247	R245-R247 PolarHBondContact O-N 2.8Å
246	L	92.1	Very high	82.7	Confident	92 Å²	92	113.6 Å²	113.6	48%	0.482	60%	0.598	S	S	.	*			trans	-64.7	121	175.3	-174.4	68.2	0	0	0	109.8	G244 K250	G244-L246 PolarHBondContact O-N 3.26Å; L246-K250 HydrophobicContact CD2-CB 3.93Å; L246-K250 HydrophobicContact CD2-CG 4.45Å
247	R	91.9	Very high	80	Confident	168 Å²	168	122 Å²	122	63%	0.634	63%	0.633	S	S	*	*			trans	-111.9	131.9	168	-60.8	-66.3	-171.8	169	4.4	107.9	R245	R245-R247 PolarHBondContact O-N 2.8Å
248	G	89.1	Confident	79.2	Confident	70 Å²	70	124.1 Å²	124.1	72%	0.722	64%	0.643	S	S	*	*	S	Bend	trans	84.9	-162.2	-172.7	0	0	0	0	0	114
249	T	82.9	Confident	78.2	Confident	125 Å²	125	125.8 Å²	125.8	77%	0.767	65%	0.652	S	S	*	*			trans	-80.3	143.1	-173.1	-53.3	0	0	0	0	112.3	T251	T249-T251 PolarHBondContact O-N 3.13Å; T249-T251 VanDerWaalsContact O-N 3.13Å
250	K	76.6	Confident	77.2	Confident	155 Å²	155	130.8 Å²	130.8	67%	0.674	67%	0.672	S	S	*	*			trans	-70.1	106.1	171	-175.1	177.2	176.7	-175.9	0	109.4	L246 V252	L246-K250 HydrophobicContact CD2-CB 3.93Å; L246-K250 HydrophobicContact CD2-CG 4.45Å; K250-V252 PolarHBondContact O-N 3.47Å
251	T	74.8	Confident	76.1	Confident	124 Å²	124	136.1 Å²	136.1	76%	0.761	69%	0.692	S	S	*	*			trans	-67.5	118.6	173.7	48.9	0	0	0	0	109.7	T249	T249-T251 PolarHBondContact O-N 3.13Å; T249-T251 VanDerWaalsContact O-N 3.13Å
252	V	75.6	Confident	75.2	Confident	60 Å²	60	132.5 Å²	132.5	36%	0.364	69%	0.689	S	S	.	*			trans	-89.1	107.5	168.4	-177.5	0	0	0	0	105.9	K250 E254	K250-V252 PolarHBondContact O-N 3.47Å; V252-E254 PolarHBondContact O-N 2.81Å; V252-E254 VanDerWaalsContact O-N 3.13Å
253	T	63.9	Low	74.1	Confident	81 Å²	81	129.7 Å²	129.7	50%	0.497	69%	0.691	S	S	.	*			trans	-65.2	117	174.3	-34.7	0	0	0	0	107.9	R241 K255	R241-T253 PolarHBondContact NH1-OG1 3.37Å; T253-K255 PolarHBondContact O-N 2.94Å
254	E	55.5	Low	72.7	Confident	117 Å²	117	132.8 Å²	132.8	55%	0.547	70%	0.703	S	S	.	*			trans	-63.7	118.8	166.5	-61.9	-166.4	166.5	0	0	106.4	K155 V252 E256	K155-E254 WeakPolarHBondContact CE-OE1 3.45Å; K155-E254 IonicContact NZ-OE1 4Å; K155-E254 PolarHBondContact NZ-OE1 3.46Å; V252-E254 PolarHBondContact O-N 2.81Å; V252-E254 VanDerWaalsContact O-N 3.13Å; E254-E256 PolarHBondContact O-N 3.48Å
255	K	49.7	Very low	71	Confident	177 Å²	177	137.2 Å²	137.2	77%	0.77	70%	0.697	S	S	*	*			trans	-84.8	106.6	164.3	-76.4	-172.1	175.3	-171.8	0	104.8	T253 N257	T253-K255 PolarHBondContact O-N 2.94Å; K255-N257 PolarHBondContact O-N 3.23Å
256	E	37.6	Very low	69.1	Low	192 Å²	192	131.9 Å²	131.9	90%	0.897	69%	0.692	S	S	*	*			trans	-58.2	116.5	161.2	-71	178.6	162.1	0	0	106.8	E254	E254-E256 PolarHBondContact O-N 3.48Å
257	N	39.7	Very low	67	Low	222 Å²	222	135.5 Å²	135.5	100%	1.187	71%	0.711	S	S	*	*			trans	-126	0	172.8	-96.5	29.1	0	0	0	106.6	K255	K255-N257 PolarHBondContact O-N 3.23Å

Retrieved 257 of 257 residues in 156.4 ms (Link to these results)

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