X5D7T7_HUMAN Loading...

C-terminal-binding protein 1

Corepressor targeting diverse transcription regulators such as GLIS2 or BCL6. Has dehydrogenase activity. Involved in controlling the equilibrium between tubular and stacked structures in the Golgi complex. Functions in brown adipose tissue (BAT) differentiation.

AlphaFold DB , UniProt , Accession X5D7T7, Species HUMAN (Homo sapiens, Human), Gene CTBP1, Length 329 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	37.1	Very low	37.6	Very low	249 Å²	249	151.6 Å²	151.6	100%	1.227	87%	0.87	S	S	*	*				0	92.6	0	-63.8	179.1	-177.3	0	0	105.5
2	G	35.7	Very low	37.7	Very low	73 Å²	73	148.8 Å²	148.8	75%	0.753	86%	0.861	S	S	*	*				102.3	102.4	70.9	0	0	0	0	0	107.2
3	S	32.8	Very low	38.6	Very low	132 Å²	132	151.6 Å²	151.6	92%	0.923	87%	0.869	S	S	*	*				162.2	119.7	129.7	-82.8	0	0	0	0	111.8
4	S	35	Very low	39.5	Very low	110 Å²	110	146.1 Å²	146.1	77%	0.769	86%	0.862	S	S	*	*			trans	-80	130	178.7	48	0	0	0	0	112.1
5	H	37.3	Very low	39.8	Very low	192 Å²	192	145.3 Å²	145.3	89%	0.889	86%	0.859	S	S	*	*			trans	-126.5	99.2	153.3	-88.9	-44.3	0	0	0	108.2
6	L	39.5	Very low	40	Very low	172 Å²	172	150.9 Å²	150.9	90%	0.901	86%	0.86	S	S	*	*			trans	-108.9	126.2	166.8	-90.3	165.5	0	0	0	108.7
7	L	37.7	Very low	40.1	Very low	157 Å²	157	148.5 Å²	148.5	82%	0.822	85%	0.852	S	S	*	*			trans	-60	133.1	-178.1	-80.4	93	0	0	0	111.9	K9	L7-K9 PolarHBondContact O-N 3.34Å
8	N	37.6	Very low	40.3	Very low	163 Å²	163	146.7 Å²	146.7	87%	0.872	85%	0.846	S	S	*	*			trans	-72.6	103	167.4	-162.6	10.2	0	0	0	109.1
9	K	42.1	Very low	41	Very low	185 Å²	185	147.2 Å²	147.2	80%	0.804	84%	0.844	S	S	*	*			trans	-97.4	110.1	163.9	-80.5	-172.7	177.1	-178.6	0	107.9	L7	L7-K9 PolarHBondContact O-N 3.34Å
10	G	36.7	Very low	41	Very low	74 Å²	74	148.7 Å²	148.7	76%	0.763	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-60	133.9	178.4	0	0	0	0	0	112.6
11	L	41.7	Very low	41.3	Very low	161 Å²	161	149.5 Å²	149.5	84%	0.843	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-81.2	147	163.5	-90.7	95.4	0	0	0	110	L13	L11-L13 PolarHBondContact O-N 2.95Å
12	P	39	Very low	41.9	Very low	118 Å²	118	140 Å²	140	77%	0.766	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-69.2	131.8	176.9	25	-25.4	0	0	0	110.9	G14	P12-G14 PolarHBondContact O-N 3.15Å
13	L	50.1	Low	42.5	Very low	185 Å²	185	142.4 Å²	142.4	97%	0.969	82%	0.816	S	S	*	*	S	Bend	trans	-58.8	110.9	166.6	-78.3	149.7	0	0	0	109	L11	L11-L13 PolarHBondContact O-N 2.95Å
14	G	50.3	Low	43.5	Very low	74 Å²	74	143.9 Å²	143.9	76%	0.763	81%	0.812	S	S	*	*			trans	161.8	1.6	172.7	0	0	0	0	0	119.6	P12	P12-G14 PolarHBondContact O-N 3.15Å
15	V	45	Very low	44.5	Very low	135 Å²	135	147 Å²	147	82%	0.818	81%	0.814	S	S	*	*			trans	-125.2	114	-180	-172.3	0	0	0	0	110
16	R	42.7	Very low	46.3	Very low	234 Å²	234	143.4 Å²	143.4	88%	0.883	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-58.2	138.2	169	-77.4	-178	176.3	-176.5	-1.2	108.7
17	P	41.3	Very low	48.8	Very low	110 Å²	110	141.3 Å²	141.3	71%	0.714	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-59.5	147.6	173.7	24.9	-31.4	0	0	0	110	I19	P17-I19 PolarHBondContact O-N 3.49Å
18	P	44.5	Very low	51.6	Low	116 Å²	116	136.6 Å²	136.6	75%	0.753	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-59	135.9	177.1	23.9	-31	0	0	0	109.5	M20	P18-M20 PolarHBondContact O-N 2.69Å
19	I	52.3	Low	54.5	Low	157 Å²	157	129.9 Å²	129.9	81%	0.805	73%	0.731	S	S	*	*			trans	-56.1	111.6	174.5	-61.3	172.1	0	0	0	106.9	P17 N21	P17-I19 PolarHBondContact O-N 3.49Å; I19-N21 PolarHBondContact O-N 2.76Å
20	M	41.2	Very low	57.2	Low	177 Å²	177	122.1 Å²	122.1	87%	0.872	70%	0.699	S	S	*	*			trans	-64.6	120.9	170	-70.5	-176.7	73.3	0	0	107.3	P18 G22	P18-M20 PolarHBondContact O-N 2.69Å; M20-G22 PolarHBondContact O-N 3.02Å
21	N	47.9	Very low	60.2	Low	165 Å²	165	118.6 Å²	118.6	88%	0.882	66%	0.663	S	S	*	*			trans	-66.5	79.5	166.7	-78	-22.5	0	0	0	108.7	I19	I19-N21 PolarHBondContact O-N 2.76Å
22	G	49.3	Very low	62.9	Low	50 Å²	50	111 Å²	111	52%	0.515	62%	0.623	S	S	.	*			trans	-70.1	166.3	157.7	0	0	0	0	0	110.1	M20 L24	M20-G22 PolarHBondContact O-N 3.02Å; G22-L24 PolarHBondContact O-N 3.01Å
23	P	48.9	Very low	65.7	Low	123 Å²	123	105.3 Å²	105.3	80%	0.799	59%	0.586	S	S	*	*			trans	-52.9	133.1	172.6	23.2	-31	0	0	0	108.6	H25	P23-H25 PolarHBondContact O-N 2.99Å
24	L	53.4	Low	68	Low	163 Å²	163	97.1 Å²	97.1	85%	0.853	54%	0.543	S	S	*	.			trans	-44.9	117	173.6	-86	114.7	0	0	0	107.5	G22 P26	G22-L24 PolarHBondContact O-N 3.01Å; L24-P26 VanDerWaalsContact O-N 3.12Å
25	H	55.2	Low	70.3	Confident	175 Å²	175	94.1 Å²	94.1	81%	0.81	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-50.4	127	167.7	-74.3	-71	0	0	0	106.7	P23 R27	P23-H25 PolarHBondContact O-N 2.99Å; H25-R27 PolarHBondContact O-N 3.45Å
26	P	76.7	Confident	72.8	Confident	117 Å²	117	95.9 Å²	95.9	76%	0.76	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-55.6	130.3	-179.8	20.7	-29.9	0	0	0	107.8	L24	L24-P26 VanDerWaalsContact O-N 3.12Å
27	R	91.6	Very high	75.4	Confident	128 Å²	128	89.3 Å²	89.3	48%	0.483	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-53.7	131.6	179.9	-71	178.5	-179.8	179.1	-9.2	108.4	H25 L29 K46 T50	H25-R27 PolarHBondContact O-N 3.45Å; R27-L29 PolarHBondContact O-N 3.12Å; R27-K46 PolarHBondContact NH1-O 3.27Å; R27-T50 PolarHBondContact O-OG1 3.33Å
28	P	97.2	Very high	78.1	Confident	59 Å²	59	84.3 Å²	84.3	38%	0.383	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-54.3	140.3	-177.7	23.1	-34.6	0	0	0	110.6	V48 A49 T50 V71	P28-V48 VanDerWaalsContact CD-O 3.29Å; P28-V48 WeakPolarHBondContact CD-O 3.29Å; P28-V48 WeakPolarHBondContact CG-O 3.28Å; P28-A49 HydrophobicContact CG-CB 4.42Å; P28-A49 CarbonylContact O-C 3.59Å; P28-A49 WeakPolarHBondContact O-CA 3.44Å; P28-A49 WeakPolarHBondContact O-CB 3.23Å; P28-T50 PolarHBondContact O-N 2.71Å; P28-V71 HydrophobicContact CB-CB 3.98Å; P28-V71 HydrophobicContact CB-CG1 4.42Å; P28-V71 HydrophobicContact CB-CG2 3.88Å
29	L	98.3	Very high	80.7	Confident	21 Å²	21	83.3 Å²	83.3	11%	0.11	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	127.3	176.7	177.3	63	0	0	0	109.6	R27 T50 A52 V66 E69 A70 V71 G72	R27-L29 PolarHBondContact O-N 3.12Å; L29-T50 WeakPolarHBondContact CA-O 3.46Å; L29-T50 HydrophobicContact CD1-CG2 4.43Å; L29-A52 HydrophobicContact CD1-CB 3.93Å; L29-V66 HydrophobicContact CD2-CG2 4.35Å; L29-E69 HydrophobicContact CD2-CB 4.2Å; L29-A70 HydrophobicContact CD2-CB 4.3Å; L29-A70 HydrophobicContact CG-CB 4.35Å; L29-V71 PolarHBondContact O-N 3.44Å; L29-G72 PolarHBondContact O-N 3.14Å
30	V	98.8	Very high	82.8	Confident	22 Å²	22	80.6 Å²	80.6	13%	0.133	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.4	168.1	176.6	0	0	0	0	108.1	L45 A49 T50 V51 A52 G72 L74	V30-L45 HydrophobicContact CG1-CD1 4.24Å; V30-A49 HydrophobicContact CB-CB 4.38Å; V30-A49 HydrophobicContact CG2-CB 3.71Å; V30-T50 PolarHBondContact N-O 3.36Å; V30-V51 WeakPolarHBondContact O-CA 3.29Å; V30-A52 PolarHBondContact O-N 3.26Å; V30-G72 VanDerWaalsContact CA-O 3.29Å; V30-G72 WeakPolarHBondContact CA-O 3.25Å; V30-L74 HydrophobicContact CG1-CD1 4.44Å; V30-L74 HydrophobicContact CG1-CG 4.15Å
31	A	98.7	Very high	85.6	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.6	-176.7	0	0	0	0	0	111.8	L33 A52 V66 A70 G72 A73 L74	A31-L33 HydrophobicContact CB-CD2 4.11Å; A31-A52 CarbonylContact C-O 3.58Å; A31-A52 WeakPolarHBondContact CA-O 3.24Å; A31-V66 HydrophobicContact CB-CG1 3.55Å; A31-V66 HydrophobicContact CB-CG2 4.39Å; A31-A70 HydrophobicContact CB-CB 4.48Å; A31-G72 PolarHBondContact N-O 2.76Å; A31-A73 CarbonylContact O-C 3.58Å; A31-A73 VanDerWaalsContact O-CA 3.29Å; A31-A73 WeakPolarHBondContact O-CA 3.46Å; A31-L74 PolarHBondContact O-N 3.07Å
32	L	98.8	Very high	87.9	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.005	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	112	162.5	176.5	62	0	0	0	108.8	D37 C38 A52 F53 C54 L74 Y76 I98	L32-D37 WeakPolarHBondContact CD2-O 3.48Å; L32-C38 VanDerWaalsContact CD2-SG 3.56Å; L32-A52 PolarHBondContact N-O 2.92Å; L32-F53 HydrophobicContact CB-CB 4.13Å; L32-F53 CarbonylContact O-C 3.48Å; L32-F53 VanDerWaalsContact O-CA 3.29Å; L32-F53 WeakPolarHBondContact O-CA 3.28Å; L32-C54 PolarHBondContact O-N 3.08Å; L32-L74 CarbonylContact C-O 3.55Å; L32-L74 WeakPolarHBondContact CA-O 3.2Å; L32-L74 HydrophobicContact CD1-CB 3.91Å; L32-Y76 HydrophobicContact CD1-CD2 4.13Å; L32-Y76 HydrophobicContact CD1-CE2 3.83Å; L32-I98 HydrophobicContact CD1-CD1 4.12Å
33	L	98.8	Very high	90.2	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.381	C	S	.	.	S	Bend	trans	-74.6	-56.4	-168.4	-56.1	-172.3	0	0	0	112.5	A31 C54 D55 A56 I62 A73 L74 M75 I79 L81 F89	A31-L33 HydrophobicContact CB-CD2 4.11Å; L33-C54 VanDerWaalsContact O-CB 3.31Å; L33-C54 WeakPolarHBondContact O-CB 3.27Å; L33-D55 PolarHBondContact O-N 3.21Å; L33-A56 WeakPolarHBondContact O-CB 3.48Å; L33-A56 PolarHBondContact O-N 3.33Å; L33-I62 HydrophobicContact CD1-CD1 4.48Å; L33-I62 HydrophobicContact CD2-CD1 4.2Å; L33-A73 HydrophobicContact CD1-CB 4.11Å; L33-A73 HydrophobicContact CD2-CB 4.14Å; L33-A73 HydrophobicContact CG-CB 4.12Å; L33-L74 PolarHBondContact N-O 3.35Å; L33-M75 HydrophobicContact CB-CB 4.18Å; L33-M75 HydrophobicContact CD1-CB 4.21Å; L33-M75 HydrophobicContact CD1-SD 4.13Å; L33-M75 HydrophobicContact CG-CB 4.3Å; L33-I79 HydrophobicContact CB-CG2 4.36Å; L33-L81 HydrophobicContact CD1-CD1 4.02Å; L33-F89 HydrophobicContact CD1-CZ 4.43Å
34	D	98.4	Very high	92.5	Very high	13 Å²	13	71.7 Å²	71.7	7%	0.07	37%	0.374	C	S	.	.	S	Bend	trans	-111.9	30.1	-168.8	61.1	-21.3	0	0	0	112.4	A56 M75 Y76 T78 I79	D34-A56 WeakPolarHBondContact CA-O 3.29Å; D34-A56 WeakPolarHBondContact CB-O 3.38Å; D34-M75 WeakPolarHBondContact OD1-CA 3.2Å; D34-M75 WeakPolarHBondContact OD1-CB 3.44Å; D34-Y76 VanDerWaalsContact CG-N 3.28Å; D34-Y76 PolarHBondContact OD1-N 2.93Å; D34-Y76 VanDerWaalsContact OD2-CA 3.26Å; D34-Y76 WeakPolarHBondContact OD2-CA 3.39Å; D34-Y76 WeakPolarHBondContact OD2-CB 3.38Å; D34-Y76 PolarHBondContact OD2-N 2.84Å; D34-T78 WeakPolarHBondContact CB-OG1 3.34Å; D34-T78 PolarHBondContact OD2-N 2.89Å; D34-T78 PolarHBondContact OD2-OG1 2.82Å; D34-I79 HydrophobicContact CB-CB 3.9Å; D34-I79 HydrophobicContact CB-CG2 3.66Å; D34-I79 PolarHBondContact OD2-N 2.93Å
35	G	97.8	Very high	94.6	Very high	10 Å²	10	66 Å²	66	10%	0.103	34%	0.344	C	S	.	.			trans	-143.9	167.6	175.4	0	0	0	0	0	111.7	F53 D55	G35-F53 WeakPolarHBondContact O-CB 3.32Å; G35-D55 PolarHBondContact O-N 3.41Å; G35-D55 VanDerWaalsContact O-N 3.17Å
36	R	97.1	Very high	96.5	Very high	172 Å²	172	63.3 Å²	63.3	65%	0.649	33%	0.33	S	S	*	.	S	Bend	trans	-114.7	-28.8	-177.7	-166.5	177.2	-162	167.7	9.9	113.7	F53 D55	R36-F53 HydrophobicContact CB-CD2 4.4Å; R36-F53 HydrophobicContact CG-CD2 4Å; R36-F53 HydrophobicContact CG-CE2 3.65Å; R36-F53 HydrophobicContact CG-CZ 4.03Å; R36-F53 VanDerWaalsContact O-CD1 3.31Å; R36-F53 WeakPolarHBondContact O-CD1 3.34Å; R36-F53 WeakPolarHBondContact O-CG 3.27Å; R36-D55 HydrophobicContact CB-CB 4.4Å
37	D	97.9	Very high	97.4	Very high	97 Å²	97	63.1 Å²	63.1	52%	0.519	32%	0.323	S	S	.	.			trans	-94.5	119.5	-176.3	-167.4	-19.5	0	0	0	110	L32 T39	L32-D37 WeakPolarHBondContact CD2-O 3.48Å; D37-T39 WeakPolarHBondContact OD1-CB 3.19Å; D37-T39 WeakPolarHBondContact OD1-CG2 3.32Å; D37-T39 PolarHBondContact OD1-N 2.99Å; D37-T39 PolarHBondContact OD1-OG1 3.48Å
38	C	97.7	Very high	97.7	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.034	33%	0.327	C	S	.	.			trans	-118	19	173.7	-61.5	0	0	0	0	112.1	L32 V40 E41 M42 V51	L32-C38 VanDerWaalsContact CD2-SG 3.56Å; C38-V40 PolarHBondContact O-N 3.45Å; C38-E41 VanDerWaalsContact C-OE2 3.28Å; C38-E41 VanDerWaalsContact CA-OE2 3.27Å; C38-E41 WeakPolarHBondContact CA-OE2 3.24Å; C38-E41 PolarHBondContact O-N 3.39Å; C38-M42 HydrophobicContact CB-CE 4.17Å; C38-M42 HydrophobicContact CB-CG 4.1Å; C38-M42 VanDerWaalsContact O-CB 3.25Å; C38-M42 WeakPolarHBondContact O-CB 3.26Å; C38-M42 VanDerWaalsContact O-CG 3.23Å; C38-M42 WeakPolarHBondContact O-CG 3.31Å; C38-M42 PolarHBondContact O-N 3.36Å; C38-V51 HydrophobicContact CB-CG1 3.83Å
39	T	98.2	Very high	97.7	Very high	94 Å²	94	59 Å²	59	58%	0.577	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.9	-171.6	54.2	0	0	0	0	113.1	D37 P43	D37-T39 WeakPolarHBondContact OD1-CB 3.19Å; D37-T39 WeakPolarHBondContact OD1-CG2 3.32Å; D37-T39 PolarHBondContact OD1-N 2.99Å; D37-T39 PolarHBondContact OD1-OG1 3.48Å; T39-P43 WeakPolarHBondContact O-CD 3.48Å; T39-P43 WeakPolarHBondContact O-CG 3.36Å
40	V	98.3	Very high	97.7	Very high	100 Å²	100	61.4 Å²	61.4	61%	0.606	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-41.9	177.3	176.9	0	0	0	0	111.1	C38 P43 I44	C38-V40 PolarHBondContact O-N 3.45Å; V40-P43 WeakPolarHBondContact O-CD 3.48Å; V40-I44 WeakPolarHBondContact O-CD1 3.49Å; V40-I44 WeakPolarHBondContact O-CG1 3.42Å
41	E	98.3	Very high	97.7	Very high	31 Å²	31	61.5 Å²	61.5	15%	0.145	33%	0.328	C	S	.	.	H	α-helix	trans	-77.6	-35.4	-175.4	-61.2	77.7	-172.2	0	0	111.9	C38 I44 L45 L74	C38-E41 VanDerWaalsContact C-OE2 3.28Å; C38-E41 VanDerWaalsContact CA-OE2 3.27Å; C38-E41 WeakPolarHBondContact CA-OE2 3.24Å; C38-E41 PolarHBondContact O-N 3.39Å; E41-I44 WeakPolarHBondContact O-CB 3.49Å; E41-I44 PolarHBondContact O-N 3.35Å; E41-I44 VanDerWaalsContact O-N 3.1Å; E41-L45 HydrophobicContact CB-CD1 4.43Å; E41-L45 PolarHBondContact O-N 3.16Å; E41-L74 HydrophobicContact CB-CD1 4.31Å; E41-L74 HydrophobicContact CG-CD1 3.74Å
42	M	96.3	Very high	97.6	Very high	87 Å²	87	63.1 Å²	63.1	43%	0.429	34%	0.341	S	S	.	.	H	α-helix	trans	-55.1	-52.6	-177.6	-86.6	-173.2	-178.6	0	0	112.6	C38 I44 L45 K46 V51	C38-M42 HydrophobicContact CB-CE 4.17Å; C38-M42 HydrophobicContact CB-CG 4.1Å; C38-M42 VanDerWaalsContact O-CB 3.25Å; C38-M42 WeakPolarHBondContact O-CB 3.26Å; C38-M42 VanDerWaalsContact O-CG 3.23Å; C38-M42 WeakPolarHBondContact O-CG 3.31Å; C38-M42 PolarHBondContact O-N 3.36Å; M42-I44 PolarHBondContact O-N 2.62Å; M42-L45 PolarHBondContact O-N 3.28Å; M42-K46 WeakPolarHBondContact O-CA 3.42Å; M42-K46 VanDerWaalsContact O-CB 3.27Å; M42-K46 WeakPolarHBondContact O-CB 3.16Å; M42-K46 PolarHBondContact O-N 3.1Å; M42-V51 HydrophobicContact CG-CB 4.04Å; M42-V51 HydrophobicContact CG-CG1 4.12Å
43	P	97.9	Very high	97.6	Very high	81 Å²	81	67.8 Å²	67.8	53%	0.526	36%	0.361	S	S	.	.	H	α-helix	trans	-59.3	-30.5	178	-25.2	34.3	0	0	0	114.2	T39 V40	T39-P43 WeakPolarHBondContact O-CD 3.48Å; T39-P43 WeakPolarHBondContact O-CG 3.36Å; V40-P43 WeakPolarHBondContact O-CD 3.48Å
44	I	98.4	Very high	97.6	Very high	129 Å²	129	69.2 Å²	69.2	66%	0.662	37%	0.371	S	S	*	.	H	α-helix	trans	-76.2	-40.3	-178.9	-58.7	171.2	0	0	0	110.4	V40 E41 M42	V40-I44 WeakPolarHBondContact O-CD1 3.49Å; V40-I44 WeakPolarHBondContact O-CG1 3.42Å; E41-I44 WeakPolarHBondContact O-CB 3.49Å; E41-I44 PolarHBondContact O-N 3.35Å; E41-I44 VanDerWaalsContact O-N 3.1Å; M42-I44 PolarHBondContact O-N 2.62Å
45	L	97.6	Very high	97.5	Very high	43 Å²	43	72.4 Å²	72.4	23%	0.225	39%	0.388	C	S	.	.	H	α-helix	trans	-97.9	-7.2	-173.5	-62.7	178.1	0	0	0	114.1	V30 E41 M42 D47 V48 A49 V51	V30-L45 HydrophobicContact CG1-CD1 4.24Å; E41-L45 HydrophobicContact CB-CD1 4.43Å; E41-L45 PolarHBondContact O-N 3.16Å; M42-L45 PolarHBondContact O-N 3.28Å; L45-D47 PolarHBondContact O-N 3.29Å; L45-V48 HydrophobicContact CD2-CG2 4.26Å; L45-V48 WeakPolarHBondContact O-CG2 3.45Å; L45-V48 PolarHBondContact O-N 3.5Å; L45-A49 HydrophobicContact CB-CB 4.45Å; L45-A49 PolarHBondContact O-N 3.37Å; L45-V51 HydrophobicContact CB-CG2 3.71Å; L45-V51 HydrophobicContact CD1-CG2 3.88Å; L45-V51 HydrophobicContact CG-CG2 4.44Å
46	K	94.1	Very high	97.6	Very high	120 Å²	120	72 Å²	72	52%	0.522	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-31.4	-170.3	69.5	-178.2	-173.8	179.2	0	115.1	R27 M42	R27-K46 PolarHBondContact NH1-O 3.27Å; M42-K46 WeakPolarHBondContact O-CA 3.42Å; M42-K46 VanDerWaalsContact O-CB 3.27Å; M42-K46 WeakPolarHBondContact O-CB 3.16Å; M42-K46 PolarHBondContact O-N 3.1Å
47	D	95.9	Very high	97.5	Very high	113 Å²	113	71.1 Å²	71.1	60%	0.604	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-15.4	-173.8	-64.6	-42.5	0	0	0	112.3	L45	L45-D47 PolarHBondContact O-N 3.29Å
48	V	97.1	Very high	97.5	Very high	94 Å²	94	68.1 Å²	68.1	57%	0.57	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	-22.1	-170.1	-62.3	0	0	0	0	114.4	P28 L45	P28-V48 VanDerWaalsContact CD-O 3.29Å; P28-V48 WeakPolarHBondContact CD-O 3.29Å; P28-V48 WeakPolarHBondContact CG-O 3.28Å; L45-V48 HydrophobicContact CD2-CG2 4.26Å; L45-V48 WeakPolarHBondContact O-CG2 3.45Å; L45-V48 PolarHBondContact O-N 3.5Å
49	A	97.9	Very high	97.4	Very high	7 Å²	7	68.1 Å²	68.1	6%	0.058	37%	0.373	C	S	.	.			trans	-143.5	156.9	-176.6	0	0	0	0	0	112.4	P28 V30 L45	P28-A49 HydrophobicContact CG-CB 4.42Å; P28-A49 CarbonylContact O-C 3.59Å; P28-A49 WeakPolarHBondContact O-CA 3.44Å; P28-A49 WeakPolarHBondContact O-CB 3.23Å; V30-A49 HydrophobicContact CB-CB 4.38Å; V30-A49 HydrophobicContact CG2-CB 3.71Å; L45-A49 HydrophobicContact CB-CB 4.45Å; L45-A49 PolarHBondContact O-N 3.37Å
50	T	97.9	Very high	97.4	Very high	71 Å²	71	70.6 Å²	70.6	44%	0.436	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	119.6	162.8	-55.2	0	0	0	0	107.3	R27 P28 L29 V30	R27-T50 PolarHBondContact O-OG1 3.33Å; P28-T50 PolarHBondContact O-N 2.71Å; L29-T50 WeakPolarHBondContact CA-O 3.46Å; L29-T50 HydrophobicContact CD1-CG2 4.43Å; V30-T50 PolarHBondContact N-O 3.36Å
51	V	97.9	Very high	97.4	Very high	24 Å²	24	70.5 Å²	70.5	15%	0.145	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	128.8	179.3	-177.1	0	0	0	0	109.7	V30 C38 M42 L45	V30-V51 WeakPolarHBondContact O-CA 3.29Å; C38-V51 HydrophobicContact CB-CG1 3.83Å; M42-V51 HydrophobicContact CG-CB 4.04Å; M42-V51 HydrophobicContact CG-CG1 4.12Å; L45-V51 HydrophobicContact CB-CG2 3.71Å; L45-V51 HydrophobicContact CD1-CG2 3.88Å; L45-V51 HydrophobicContact CG-CG2 4.44Å
52	A	97.8	Very high	97.4	Very high	33 Å²	33	69.4 Å²	69.4	27%	0.273	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	168.5	173.1	0	0	0	0	0	110.3	L29 V30 A31 L32	L29-A52 HydrophobicContact CD1-CB 3.93Å; V30-A52 PolarHBondContact O-N 3.26Å; A31-A52 CarbonylContact C-O 3.58Å; A31-A52 WeakPolarHBondContact CA-O 3.24Å; L32-A52 PolarHBondContact N-O 2.92Å
53	F	98.3	Very high	97.4	Very high	99 Å²	99	71.5 Å²	71.5	43%	0.434	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	156.9	174	67.9	-97.3	0	0	0	110.6	L32 G35 R36 D55	L32-F53 HydrophobicContact CB-CB 4.13Å; L32-F53 CarbonylContact O-C 3.48Å; L32-F53 VanDerWaalsContact O-CA 3.29Å; L32-F53 WeakPolarHBondContact O-CA 3.28Å; G35-F53 WeakPolarHBondContact O-CB 3.32Å; R36-F53 HydrophobicContact CB-CD2 4.4Å; R36-F53 HydrophobicContact CG-CD2 4Å; R36-F53 HydrophobicContact CG-CE2 3.65Å; R36-F53 HydrophobicContact CG-CZ 4.03Å; R36-F53 VanDerWaalsContact O-CD1 3.31Å; R36-F53 WeakPolarHBondContact O-CD1 3.34Å; R36-F53 WeakPolarHBondContact O-CG 3.27Å; F53-D55 HydrophobicContact CD2-CB 4.36Å
54	C	98.3	Very high	97.4	Very high	30 Å²	30	74.4 Å²	74.4	20%	0.203	38%	0.381	C	S	.	.			trans	-112.9	-30.2	179	-52.6	0	0	0	0	113.1	L32 L33 A56	L32-C54 PolarHBondContact O-N 3.08Å; L33-C54 VanDerWaalsContact O-CB 3.31Å; L33-C54 WeakPolarHBondContact O-CB 3.27Å; C54-A56 HydrophobicContact CB-CB 4.04Å; C54-A56 PolarHBondContact O-N 2.92Å
55	D	97.9	Very high	97.4	Very high	80 Å²	80	73.6 Å²	73.6	43%	0.428	37%	0.373	S	S	.	.			trans	54.2	36.7	-173.2	-159.4	26.1	0	0	0	112.3	L33 G35 R36 F53	L33-D55 PolarHBondContact O-N 3.21Å; G35-D55 PolarHBondContact O-N 3.41Å; G35-D55 VanDerWaalsContact O-N 3.17Å; R36-D55 HydrophobicContact CB-CB 4.4Å; F53-D55 HydrophobicContact CD2-CB 4.36Å
56	A	98.1	Very high	97.4	Very high	2 Å²	2	72.1 Å²	72.1	2%	0.017	37%	0.366	C	S	.	.			trans	-94.3	135	-172.3	0	0	0	0	0	111.8	L33 D34 C54 E61 I62 I79	L33-A56 WeakPolarHBondContact O-CB 3.48Å; L33-A56 PolarHBondContact O-N 3.33Å; D34-A56 WeakPolarHBondContact CA-O 3.29Å; D34-A56 WeakPolarHBondContact CB-O 3.38Å; C54-A56 HydrophobicContact CB-CB 4.04Å; C54-A56 PolarHBondContact O-N 2.92Å; A56-E61 HydrophobicContact CB-CB 3.77Å; A56-I62 HydrophobicContact CB-CG1 3.86Å; A56-I79 HydrophobicContact CB-CD1 4.49Å
57	Q	96	Very high	97.6	Very high	154 Å²	154	67.6 Å²	67.6	72%	0.72	35%	0.347	S	S	*	.	S	Bend	trans	-90.8	-16	171.8	-62.5	179.8	29.3	0	0	112.3	E61	Q57-E61 PolarHBondContact N-OE2 3.29Å
58	S	97.3	Very high	97.8	Very high	34 Å²	34	66.3 Å²	66.3	24%	0.238	34%	0.34	C	S	.	.	S	Bend	trans	-148.1	157.6	-178.1	68.8	0	0	0	0	111	Q60 E61	S58-Q60 VanDerWaalsContact CB-OE1 3.29Å; S58-Q60 PolarHBondContact O-N 3.17Å; S58-Q60 VanDerWaalsContact O-N 3.12Å; S58-Q60 PolarHBondContact OG-OE1 3.5Å; S58-E61 PolarHBondContact O-N 2.97Å; S58-E61 PolarHBondContact OG-OE1 3.39Å
59	T	96.6	Very high	97.8	Very high	4 Å²	4	66.7 Å²	66.7	3%	0.025	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-61.4	-23.6	-179.8	-44.2	0	0	0	0	112.5	E61 I62 L67 D85 K88	T59-E61 PolarHBondContact O-N 2.97Å; T59-I62 HydrophobicContact CG2-CD1 4.2Å; T59-I62 PolarHBondContact O-N 3.27Å; T59-L67 HydrophobicContact CG2-CD2 4.38Å; T59-D85 WeakPolarHBondContact CB-OD1 3.5Å; T59-D85 HydrophobicContact CG2-CB 3.99Å; T59-D85 WeakPolarHBondContact OG1-CB 3.26Å; T59-D85 PolarHBondContact OG1-OD1 3.24Å; T59-K88 HydrophobicContact CG2-CD 3.67Å
60	Q	97.2	Very high	97.9	Very high	147 Å²	147	66.4 Å²	66.4	69%	0.687	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-66.3	-25.1	176.9	-67.7	79.6	-6.3	0	0	112.8	S58	S58-Q60 VanDerWaalsContact CB-OE1 3.29Å; S58-Q60 PolarHBondContact O-N 3.17Å; S58-Q60 VanDerWaalsContact O-N 3.12Å; S58-Q60 PolarHBondContact OG-OE1 3.5Å
61	E	97.9	Very high	97.9	Very high	97 Å²	97	65.3 Å²	65.3	45%	0.453	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-87.3	-9.7	179.2	-68.1	158.5	-129.7	0	0	112.4	A56 Q57 S58 T59 H63	A56-E61 HydrophobicContact CB-CB 3.77Å; Q57-E61 PolarHBondContact N-OE2 3.29Å; S58-E61 PolarHBondContact O-N 2.97Å; S58-E61 PolarHBondContact OG-OE1 3.39Å; T59-E61 PolarHBondContact O-N 2.97Å; E61-H63 PolarHBondContact O-N 2.85Å
62	I	98.3	Very high	97.9	Very high	8 Å²	8	64.4 Å²	64.4	4%	0.041	32%	0.322	C	S	.	.	S	Bend	trans	-76.1	120.6	179.5	-57.8	178.2	0	0	0	109.5	L33 A56 T59 V66 L67 I79 F89	L33-I62 HydrophobicContact CD1-CD1 4.48Å; L33-I62 HydrophobicContact CD2-CD1 4.2Å; A56-I62 HydrophobicContact CB-CG1 3.86Å; T59-I62 HydrophobicContact CG2-CD1 4.2Å; T59-I62 PolarHBondContact O-N 3.27Å; I62-V66 HydrophobicContact CG2-CB 3.72Å; I62-V66 HydrophobicContact CG2-CG1 3.63Å; I62-L67 HydrophobicContact CB-CD2 4.15Å; I62-L67 HydrophobicContact CB-CG 4.38Å; I62-L67 HydrophobicContact CG2-CD2 3.77Å; I62-L67 HydrophobicContact CG2-CG 3.91Å; I62-I79 HydrophobicContact CD1-CD1 4.1Å; I62-F89 HydrophobicContact CD1-CZ 3.96Å
63	H	98	Very high	98	Very high	131 Å²	131	62.9 Å²	62.9	61%	0.606	31%	0.309	S	S	*	.			trans	-59.2	139.8	179.9	-172.5	-83.8	0	0	0	112.1	E61 K65 V66 L67	E61-H63 PolarHBondContact O-N 2.85Å; H63-K65 VanDerWaalsContact ND1-CB 3.31Å; H63-K65 WeakPolarHBondContact ND1-CB 3.22Å; H63-K65 PolarHBondContact ND1-N 2.79Å; H63-K65 VanDerWaalsContact ND1-N 3.12Å; H63-K65 PolarHBondContact O-N 2.86Å; H63-V66 WeakPolarHBondContact O-CB 3.41Å; H63-V66 PolarHBondContact O-N 3.33Å; H63-L67 PolarHBondContact O-N 3.08Å
64	E	97.8	Very high	98	Very high	142 Å²	142	59.2 Å²	59.2	66%	0.664	29%	0.294	S	S	*	.	H	α-helix	trans	-51.5	-38.1	-176.1	-67.4	-175.3	166	0	0	113.6	V66 L67 N68	E64-V66 VanDerWaalsContact C-N 3.28Å; E64-V66 PolarHBondContact O-N 3.08Å; E64-L67 PolarHBondContact O-N 3.41Å; E64-N68 WeakPolarHBondContact O-CB 3.17Å; E64-N68 VanDerWaalsContact O-CG 3.24Å; E64-N68 PolarHBondContact O-N 3.32Å; E64-N68 PolarHBondContact O-ND2 2.95Å; E64-N68 VanDerWaalsContact O-ND2 3.17Å
65	K	97.5	Very high	98	Very high	112 Å²	112	57.8 Å²	57.8	49%	0.487	29%	0.285	S	S	.	.	H	α-helix	trans	-53.8	-43.4	174.7	-171.1	176.5	-177.3	179.3	0	112.7	H63 N68 E69	H63-K65 VanDerWaalsContact ND1-CB 3.31Å; H63-K65 WeakPolarHBondContact ND1-CB 3.22Å; H63-K65 PolarHBondContact ND1-N 2.79Å; H63-K65 VanDerWaalsContact ND1-N 3.12Å; H63-K65 PolarHBondContact O-N 2.86Å; K65-N68 PolarHBondContact O-N 2.84Å; K65-E69 WeakPolarHBondContact CE-OE2 3.21Å; K65-E69 HydrophobicContact CG-CG 4.36Å; K65-E69 VanDerWaalsContact O-CB 3.27Å; K65-E69 WeakPolarHBondContact O-CB 3.47Å; K65-E69 PolarHBondContact O-N 2.75Å
66	V	98.4	Very high	98.1	Very high	12 Å²	12	57.9 Å²	57.9	7%	0.073	28%	0.28	C	S	.	.	H	α-helix	trans	-67.7	-45.9	178.5	173.7	0	0	0	0	109.9	L29 A31 I62 H63 E64 N68 E69 A70 F89	L29-V66 HydrophobicContact CD2-CG2 4.35Å; A31-V66 HydrophobicContact CB-CG1 3.55Å; A31-V66 HydrophobicContact CB-CG2 4.39Å; I62-V66 HydrophobicContact CG2-CB 3.72Å; I62-V66 HydrophobicContact CG2-CG1 3.63Å; H63-V66 WeakPolarHBondContact O-CB 3.41Å; H63-V66 PolarHBondContact O-N 3.33Å; E64-V66 VanDerWaalsContact C-N 3.28Å; E64-V66 PolarHBondContact O-N 3.08Å; V66-N68 VanDerWaalsContact C-N 3.25Å; V66-N68 PolarHBondContact O-N 3.41Å; V66-E69 PolarHBondContact O-N 2.64Å; V66-A70 HydrophobicContact CG1-CB 3.93Å; V66-A70 WeakPolarHBondContact O-CB 3.22Å; V66-A70 PolarHBondContact O-N 2.85Å; V66-F89 HydrophobicContact CG1-CE1 4.45Å
67	L	98.4	Very high	98	Very high	25 Å²	25	62.8 Å²	62.8	13%	0.131	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-37.8	177.1	-61.5	175.6	0	0	0	112.1	T59 I62 H63 E64 K88 F89 K90	T59-L67 HydrophobicContact CG2-CD2 4.38Å; I62-L67 HydrophobicContact CB-CD2 4.15Å; I62-L67 HydrophobicContact CB-CG 4.38Å; I62-L67 HydrophobicContact CG2-CD2 3.77Å; I62-L67 HydrophobicContact CG2-CG 3.91Å; H63-L67 PolarHBondContact O-N 3.08Å; E64-L67 PolarHBondContact O-N 3.41Å; L67-K88 HydrophobicContact CD1-CB 4.49Å; L67-K88 HydrophobicContact CD2-CB 4.19Å; L67-F89 HydrophobicContact CD2-CD1 4.09Å; L67-F89 HydrophobicContact CD2-CD2 4.26Å; L67-F89 HydrophobicContact CD2-CE1 3.82Å; L67-F89 HydrophobicContact CD2-CE2 3.99Å; L67-F89 HydrophobicContact CD2-CG 4.32Å; L67-F89 HydrophobicContact CD2-CZ 3.76Å; L67-F89 CarbonylContact O-C 3.55Å; L67-F89 VanDerWaalsContact O-CA 3.31Å; L67-F89 WeakPolarHBondContact O-CA 3.31Å; L67-K90 PolarHBondContact O-N 3.05Å
68	N	98.3	Very high	98.1	Very high	86 Å²	86	59.1 Å²	59.1	46%	0.46	29%	0.29	S	S	.	.	H	α-helix	trans	-82.1	-36.7	-177.4	-68.5	-30.9	0	0	0	113.7	E64 K65 V66 A91	E64-N68 WeakPolarHBondContact O-CB 3.17Å; E64-N68 VanDerWaalsContact O-CG 3.24Å; E64-N68 PolarHBondContact O-N 3.32Å; E64-N68 PolarHBondContact O-ND2 2.95Å; E64-N68 VanDerWaalsContact O-ND2 3.17Å; K65-N68 PolarHBondContact O-N 2.84Å; V66-N68 VanDerWaalsContact C-N 3.25Å; V66-N68 PolarHBondContact O-N 3.41Å; N68-A91 WeakPolarHBondContact O-CB 3.37Å
69	E	98.3	Very high	98.2	Very high	102 Å²	102	57.5 Å²	57.5	48%	0.477	28%	0.279	S	S	.	.	H	α-helix	trans	-116.3	-17.4	-166	-59.5	177.7	-160.4	0	0	114.9	L29 K65 V66 V71	L29-E69 HydrophobicContact CD2-CB 4.2Å; K65-E69 WeakPolarHBondContact CE-OE2 3.21Å; K65-E69 HydrophobicContact CG-CG 4.36Å; K65-E69 VanDerWaalsContact O-CB 3.27Å; K65-E69 WeakPolarHBondContact O-CB 3.47Å; K65-E69 PolarHBondContact O-N 2.75Å; V66-E69 PolarHBondContact O-N 2.64Å; E69-V71 PolarHBondContact O-N 3.02Å
70	A	98.6	Very high	98.2	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.008	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	124.1	-176.5	0	0	0	0	0	110.9	L29 A31 V66 A91 L92	L29-A70 HydrophobicContact CD2-CB 4.3Å; L29-A70 HydrophobicContact CG-CB 4.35Å; A31-A70 HydrophobicContact CB-CB 4.48Å; V66-A70 HydrophobicContact CG1-CB 3.93Å; V66-A70 WeakPolarHBondContact O-CB 3.22Å; V66-A70 PolarHBondContact O-N 2.85Å; A70-A91 CarbonylContact O-C 3.19Å; A70-L92 WeakPolarHBondContact O-CA 3.41Å; A70-L92 PolarHBondContact O-N 3.29Å; A70-L92 VanDerWaalsContact O-N 3.07Å
71	V	98.7	Very high	98.3	Very high	49 Å²	49	54.3 Å²	54.3	30%	0.297	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-31.2	176.6	179.9	0	0	0	0	110.5	P28 L29 E69 R93 I94	P28-V71 HydrophobicContact CB-CB 3.98Å; P28-V71 HydrophobicContact CB-CG1 4.42Å; P28-V71 HydrophobicContact CB-CG2 3.88Å; L29-V71 PolarHBondContact O-N 3.44Å; E69-V71 PolarHBondContact O-N 3.02Å; V71-R93 HydrophobicContact CG1-CB 4.38Å; V71-R93 HydrophobicContact CG1-CG 4.26Å; V71-R93 PolarHBondContact O-N 3.13Å; V71-I94 PolarHBondContact O-N 2.97Å
72	G	98.8	Very high	98.3	Very high	4 Å²	4	52.5 Å²	52.5	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149.8	173.8	0	0	0	0	0	111.9	L29 V30 A31 I94	L29-G72 PolarHBondContact O-N 3.14Å; V30-G72 VanDerWaalsContact CA-O 3.29Å; V30-G72 WeakPolarHBondContact CA-O 3.25Å; A31-G72 PolarHBondContact N-O 2.76Å; G72-I94 CarbonylContact C-O 3.59Å; G72-I94 WeakPolarHBondContact CA-O 3.43Å
73	A	98.9	Very high	98.4	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.008	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	140.2	171.7	0	0	0	0	0	110.7	A31 L33 L92 I94 I95 V96	A31-A73 CarbonylContact O-C 3.58Å; A31-A73 VanDerWaalsContact O-CA 3.29Å; A31-A73 WeakPolarHBondContact O-CA 3.46Å; L33-A73 HydrophobicContact CD1-CB 4.11Å; L33-A73 HydrophobicContact CD2-CB 4.14Å; L33-A73 HydrophobicContact CG-CB 4.12Å; A73-L92 HydrophobicContact CB-CD1 3.82Å; A73-I94 PolarHBondContact N-O 3.32Å; A73-I95 HydrophobicContact CB-CG1 4.28Å; A73-I95 CarbonylContact O-C 3.53Å; A73-I95 WeakPolarHBondContact O-CA 3.31Å; A73-V96 PolarHBondContact O-N 2.91Å
74	L	98.9	Very high	98.4	Very high	23 Å²	23	57.7 Å²	57.7	12%	0.12	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.6	165.8	-58	179.5	0	0	0	107.5	V30 A31 L32 L33 E41 V96 I98	V30-L74 HydrophobicContact CG1-CD1 4.44Å; V30-L74 HydrophobicContact CG1-CG 4.15Å; A31-L74 PolarHBondContact O-N 3.07Å; L32-L74 CarbonylContact C-O 3.55Å; L32-L74 WeakPolarHBondContact CA-O 3.2Å; L32-L74 HydrophobicContact CD1-CB 3.91Å; L33-L74 PolarHBondContact N-O 3.35Å; E41-L74 HydrophobicContact CB-CD1 4.31Å; E41-L74 HydrophobicContact CG-CD1 3.74Å; L74-V96 WeakPolarHBondContact CA-O 3.41Å; L74-V96 HydrophobicContact CD2-CB 3.73Å; L74-V96 HydrophobicContact CD2-CG1 4.45Å; L74-V96 HydrophobicContact CD2-CG2 4.2Å; L74-I98 HydrophobicContact CB-CD1 4.1Å
75	M	98.8	Very high	98.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	151.6	176.5	57.6	-177.9	-74.8	0	0	112.4	L33 D34 I79 L81 I95 V96 R97 I98 N104 I105	L33-M75 HydrophobicContact CB-CB 4.18Å; L33-M75 HydrophobicContact CD1-CB 4.21Å; L33-M75 HydrophobicContact CD1-SD 4.13Å; L33-M75 HydrophobicContact CG-CB 4.3Å; D34-M75 WeakPolarHBondContact OD1-CA 3.2Å; D34-M75 WeakPolarHBondContact OD1-CB 3.44Å; M75-I79 HydrophobicContact CB-CG2 4.25Å; M75-I79 HydrophobicContact CE-CG2 3.58Å; M75-I79 WeakPolarHBondContact CE-O 3.3Å; M75-L81 HydrophobicContact CE-CD1 4.2Å; M75-L81 HydrophobicContact CE-CG 4.14Å; M75-L81 HydrophobicContact SD-CD1 3.49Å; M75-L81 WeakPolarHBondContact SD-CD1 3.44Å; M75-L81 HydrophobicContact SD-CG 4.09Å; M75-I95 HydrophobicContact CG-CG2 3.87Å; M75-I95 HydrophobicContact SD-CG2 3.6Å; M75-V96 PolarHBondContact N-O 3.04Å; M75-V96 VanDerWaalsContact N-O 3.13Å; M75-R97 HydrophobicContact CG-CG 4.49Å; M75-R97 WeakPolarHBondContact O-CA 3.45Å; M75-R97 PolarHBondContact O-NH1 2.71Å; M75-I98 PolarHBondContact O-N 2.94Å; M75-N104 VanDerWaalsContact CE-ND2 3.28Å; M75-N104 WeakPolarHBondContact CE-ND2 3.11Å; M75-I105 HydrophobicContact CE-CD1 4.11Å; M75-I105 HydrophobicContact CE-CG1 3.83Å; M75-I105 HydrophobicContact SD-CD1 3.72Å; M75-I105 HydrophobicContact SD-CG1 3.96Å
76	Y	98.4	Very high	98.5	Very high	81 Å²	81	46.4 Å²	46.4	32%	0.318	24%	0.235	S	C	.	.			trans	-89.6	-150.2	171.2	-67	-83.7	0	0	0	109.9	L32 D34 R97 I98 N104	L32-Y76 HydrophobicContact CD1-CD2 4.13Å; L32-Y76 HydrophobicContact CD1-CE2 3.83Å; D34-Y76 VanDerWaalsContact CG-N 3.28Å; D34-Y76 PolarHBondContact OD1-N 2.93Å; D34-Y76 VanDerWaalsContact OD2-CA 3.26Å; D34-Y76 WeakPolarHBondContact OD2-CA 3.39Å; D34-Y76 WeakPolarHBondContact OD2-CB 3.38Å; D34-Y76 PolarHBondContact OD2-N 2.84Å; Y76-R97 WeakPolarHBondContact O-CD 3.42Å; Y76-R97 PolarHBondContact O-NE 2.69Å; Y76-R97 PolarHBondContact O-NH1 3.38Å; Y76-R97 VanDerWaalsContact O-NH1 3.08Å; Y76-I98 HydrophobicContact CD1-CB 3.96Å; Y76-I98 HydrophobicContact CD1-CG2 4.09Å; Y76-I98 HydrophobicContact CE1-CB 3.76Å; Y76-I98 HydrophobicContact CE1-CD1 4.21Å; Y76-I98 HydrophobicContact CE1-CG2 3.47Å; Y76-I98 VanDerWaalsContact CE1-CG2 3.47Å; Y76-I98 HydrophobicContact CE2-CD1 3.92Å; Y76-N104 PolarHBondContact O-ND2 2.94Å
77	H	97.8	Very high	98.5	Very high	105 Å²	105	50.1 Å²	50.1	49%	0.486	25%	0.251	S	S	.	.	S	Bend	trans	-101.6	-3.4	-173.9	68.3	-79.7	0	0	0	113.2	E295	H77-E295 IonicContact CD2-OE2 3.59Å; H77-E295 IonicContact NE2-OE2 2.68Å
78	T	97.8	Very high	98.5	Very high	77 Å²	77	52.2 Å²	52.2	47%	0.472	26%	0.259	S	S	.	.	S	Bend	trans	-92.3	-16	-166.5	52.6	0	0	0	0	113.2	D34	D34-T78 WeakPolarHBondContact CB-OG1 3.34Å; D34-T78 PolarHBondContact OD2-N 2.89Å; D34-T78 PolarHBondContact OD2-OG1 2.82Å
79	I	98.1	Very high	98.5	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	24%	0.241	C	C	.	.	S	Bend	trans	-107	143.3	168.8	-165.3	170.6	0	0	0	111	L33 D34 A56 I62 M75 N104	L33-I79 HydrophobicContact CB-CG2 4.36Å; D34-I79 HydrophobicContact CB-CB 3.9Å; D34-I79 HydrophobicContact CB-CG2 3.66Å; D34-I79 PolarHBondContact OD2-N 2.93Å; A56-I79 HydrophobicContact CB-CD1 4.49Å; I62-I79 HydrophobicContact CD1-CD1 4.1Å; M75-I79 HydrophobicContact CB-CG2 4.25Å; M75-I79 HydrophobicContact CE-CG2 3.58Å; M75-I79 WeakPolarHBondContact CE-O 3.3Å; I79-N104 PolarHBondContact O-ND2 3.05Å
80	T	98.3	Very high	98.5	Very high	83 Å²	83	50.9 Å²	50.9	51%	0.509	25%	0.248	S	C	.	.			trans	-109.5	135.8	173.6	-63	0	0	0	0	110.1	T82 N104	T80-T82 HydrophobicContact CG2-CG2 4.4Å; T80-N104 CarbonylContact C-O 3.6Å; T80-N104 VanDerWaalsContact CA-O 3.31Å; T80-N104 WeakPolarHBondContact CA-O 3.43Å
81	L	98.7	Very high	98.5	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-114.1	99.5	176.3	-62.6	-177.8	0	0	0	110.2	L33 M75 D85 L86 F89 I95 N104 D106	L33-L81 HydrophobicContact CD1-CD1 4.02Å; M75-L81 HydrophobicContact CE-CD1 4.2Å; M75-L81 HydrophobicContact CE-CG 4.14Å; M75-L81 HydrophobicContact SD-CD1 3.49Å; M75-L81 WeakPolarHBondContact SD-CD1 3.44Å; M75-L81 HydrophobicContact SD-CG 4.09Å; L81-D85 HydrophobicContact CD2-CB 4.14Å; L81-L86 HydrophobicContact CB-CD2 4.12Å; L81-L86 HydrophobicContact CB-CG 4.26Å; L81-L86 HydrophobicContact CD1-CD2 4.17Å; L81-F89 HydrophobicContact CD2-CE2 4.41Å; L81-I95 HydrophobicContact CD1-CD1 3.91Å; L81-N104 PolarHBondContact N-O 3.28Å; L81-D106 PolarHBondContact O-N 2.95Å
82	T	98.6	Very high	98.5	Very high	59 Å²	59	50.7 Å²	50.7	36%	0.362	25%	0.25	S	C	.	.			trans	-76.5	174.2	171.5	70.4	0	0	0	0	111.1	T80 E84 D85 L86	T80-T82 HydrophobicContact CG2-CG2 4.4Å; T82-E84 VanDerWaalsContact C-N 3.3Å; T82-E84 PolarHBondContact O-N 2.99Å; T82-E84 PolarHBondContact OG1-N 3.08Å; T82-D85 WeakPolarHBondContact CB-OD2 3.44Å; T82-D85 PolarHBondContact N-OD2 2.78Å; T82-D85 VanDerWaalsContact N-OD2 3.1Å; T82-D85 WeakPolarHBondContact O-CB 3.47Å; T82-D85 PolarHBondContact O-N 2.88Å; T82-D85 VanDerWaalsContact O-N 3.15Å; T82-D85 PolarHBondContact OG1-N 3.41Å; T82-D85 PolarHBondContact OG1-OD2 3.17Å; T82-L86 VanDerWaalsContact O-CG 3.29Å; T82-L86 WeakPolarHBondContact O-CG 3.4Å; T82-L86 PolarHBondContact O-N 2.8Å
83	R	98.4	Very high	98.5	Very high	97 Å²	97	59.2 Å²	59.2	37%	0.366	28%	0.281	S	S	.	.	H	α-helix	trans	-52.9	-47.5	170.1	-174.7	171	-168.6	111.5	-3.1	112.6	D85 L86 E87 S109 D112	R83-D85 PolarHBondContact O-N 2.84Å; R83-L86 PolarHBondContact O-N 2.79Å; R83-E87 IonicContact NE-OE1 2.93Å; R83-E87 PolarHBondContact NE-OE1 2.88Å; R83-E87 WeakPolarHBondContact O-CG 3.26Å; R83-E87 PolarHBondContact O-N 3.47Å; R83-S109 WeakPolarHBondContact CB-OG 3.37Å; R83-S109 WeakPolarHBondContact CD-OG 3.39Å; R83-S109 PolarHBondContact NH1-OG 2.74Å; R83-D112 IonicContact CZ-OD2 3.56Å; R83-D112 IonicContact NH1-OD2 3.82Å; R83-D112 PolarHBondContact NH1-OD2 2.86Å; R83-D112 IonicContact NH2-OD2 3.41Å
84	E	98.6	Very high	98.5	Very high	150 Å²	150	62.3 Å²	62.3	70%	0.701	30%	0.296	S	S	*	.	H	α-helix	trans	-62.5	-31.8	-179.6	-65.1	-175.9	-178.6	0	0	112	T82 K88	T82-E84 VanDerWaalsContact C-N 3.3Å; T82-E84 PolarHBondContact O-N 2.99Å; T82-E84 PolarHBondContact OG1-N 3.08Å; E84-K88 WeakPolarHBondContact O-CE 3.46Å; E84-K88 WeakPolarHBondContact O-CG 3.4Å
85	D	98.7	Very high	98.5	Very high	16 Å²	16	61.2 Å²	61.2	9%	0.086	29%	0.291	C	S	.	.	H	α-helix	trans	-73.9	-44.1	175.8	-62.9	-54.8	0	0	0	112.1	T59 L81 T82 R83 E87 K88 F89	T59-D85 WeakPolarHBondContact CB-OD1 3.5Å; T59-D85 HydrophobicContact CG2-CB 3.99Å; T59-D85 WeakPolarHBondContact OG1-CB 3.26Å; T59-D85 PolarHBondContact OG1-OD1 3.24Å; L81-D85 HydrophobicContact CD2-CB 4.14Å; T82-D85 WeakPolarHBondContact CB-OD2 3.44Å; T82-D85 PolarHBondContact N-OD2 2.78Å; T82-D85 VanDerWaalsContact N-OD2 3.1Å; T82-D85 WeakPolarHBondContact O-CB 3.47Å; T82-D85 PolarHBondContact O-N 2.88Å; T82-D85 VanDerWaalsContact O-N 3.15Å; T82-D85 PolarHBondContact OG1-N 3.41Å; T82-D85 PolarHBondContact OG1-OD2 3.17Å; R83-D85 PolarHBondContact O-N 2.84Å; D85-E87 VanDerWaalsContact C-N 3.3Å; D85-E87 PolarHBondContact O-N 3.42Å; D85-K88 WeakPolarHBondContact O-CB 3.34Å; D85-K88 PolarHBondContact O-N 3.15Å; D85-K88 VanDerWaalsContact O-N 3.14Å; D85-K88 IonicContact OD1-NZ 3.27Å; D85-K88 PolarHBondContact OD1-NZ 3.18Å; D85-F89 WeakPolarHBondContact O-CD2 3.32Å
86	L	98.8	Very high	98.5	Very high	1 Å²	1	63 Å²	63	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-38.1	178.6	-68.4	165.8	0	0	0	111.7	L81 T82 R83 K88 F89 I95 D106 A110 L113 I115	L81-L86 HydrophobicContact CB-CD2 4.12Å; L81-L86 HydrophobicContact CB-CG 4.26Å; L81-L86 HydrophobicContact CD1-CD2 4.17Å; T82-L86 VanDerWaalsContact O-CG 3.29Å; T82-L86 WeakPolarHBondContact O-CG 3.4Å; T82-L86 PolarHBondContact O-N 2.8Å; R83-L86 PolarHBondContact O-N 2.79Å; L86-K88 PolarHBondContact O-N 2.86Å; L86-F89 PolarHBondContact O-N 2.86Å; L86-F89 VanDerWaalsContact O-N 3.09Å; L86-I95 HydrophobicContact CD2-CD1 3.57Å; L86-D106 HydrophobicContact CD1-CB 4.43Å; L86-A110 HydrophobicContact CD1-CB 3.96Å; L86-L113 HydrophobicContact CB-CD1 3.59Å; L86-I115 HydrophobicContact CB-CD1 4.49Å; L86-I115 HydrophobicContact CD2-CD1 4.25Å
87	E	98.6	Very high	98.5	Very high	90 Å²	90	59.4 Å²	59.4	42%	0.421	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-18	177.8	-73.2	176.3	-179.7	0	0	113.8	R83 D85 F89 K90 L113	R83-E87 IonicContact NE-OE1 2.93Å; R83-E87 PolarHBondContact NE-OE1 2.88Å; R83-E87 WeakPolarHBondContact O-CG 3.26Å; R83-E87 PolarHBondContact O-N 3.47Å; D85-E87 VanDerWaalsContact C-N 3.3Å; D85-E87 PolarHBondContact O-N 3.42Å; E87-F89 VanDerWaalsContact C-N 3.3Å; E87-K90 PolarHBondContact O-NZ 3.28Å; E87-L113 HydrophobicContact CG-CD1 3.98Å; E87-L113 HydrophobicContact CG-CD2 4.12Å
88	K	98.6	Very high	98.6	Very high	69 Å²	69	56.6 Å²	56.6	30%	0.3	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-28.6	174.5	-63.7	165.7	-168.9	162.7	0	111.6	T59 L67 E84 D85 L86 K90	T59-K88 HydrophobicContact CG2-CD 3.67Å; L67-K88 HydrophobicContact CD1-CB 4.49Å; L67-K88 HydrophobicContact CD2-CB 4.19Å; E84-K88 WeakPolarHBondContact O-CE 3.46Å; E84-K88 WeakPolarHBondContact O-CG 3.4Å; D85-K88 WeakPolarHBondContact O-CB 3.34Å; D85-K88 PolarHBondContact O-N 3.15Å; D85-K88 VanDerWaalsContact O-N 3.14Å; D85-K88 IonicContact OD1-NZ 3.27Å; D85-K88 PolarHBondContact OD1-NZ 3.18Å; L86-K88 PolarHBondContact O-N 2.86Å; K88-K90 WeakPolarHBondContact O-CE 3.49Å
89	F	98.7	Very high	98.5	Very high	15 Å²	15	54 Å²	54	7%	0.066	26%	0.264	C	S	.	.			trans	-77.3	123.2	179.3	-67.6	-92.2	0	0	0	111.5	L33 I62 V66 L67 L81 D85 L86 E87 L92	L33-F89 HydrophobicContact CD1-CZ 4.43Å; I62-F89 HydrophobicContact CD1-CZ 3.96Å; V66-F89 HydrophobicContact CG1-CE1 4.45Å; L67-F89 HydrophobicContact CD2-CD1 4.09Å; L67-F89 HydrophobicContact CD2-CD2 4.26Å; L67-F89 HydrophobicContact CD2-CE1 3.82Å; L67-F89 HydrophobicContact CD2-CE2 3.99Å; L67-F89 HydrophobicContact CD2-CG 4.32Å; L67-F89 HydrophobicContact CD2-CZ 3.76Å; L67-F89 CarbonylContact O-C 3.55Å; L67-F89 VanDerWaalsContact O-CA 3.31Å; L67-F89 WeakPolarHBondContact O-CA 3.31Å; L81-F89 HydrophobicContact CD2-CE2 4.41Å; D85-F89 WeakPolarHBondContact O-CD2 3.32Å; L86-F89 PolarHBondContact O-N 2.86Å; L86-F89 VanDerWaalsContact O-N 3.09Å; E87-F89 VanDerWaalsContact C-N 3.3Å; F89-L92 HydrophobicContact CB-CB 3.61Å; F89-L92 HydrophobicContact CB-CD2 4Å; F89-L92 HydrophobicContact CB-CG 4.47Å; F89-L92 HydrophobicContact CD1-CB 4.17Å; F89-L92 HydrophobicContact CD1-CD2 3.85Å; F89-L92 HydrophobicContact CD1-CG 4.47Å; F89-L92 HydrophobicContact CD2-CD2 4.11Å; F89-L92 HydrophobicContact CE1-CD2 4.31Å; F89-L92 HydrophobicContact CG-CB 4.11Å; F89-L92 HydrophobicContact CG-CD2 3.72Å
90	K	98.5	Very high	98.4	Very high	145 Å²	145	57 Å²	57	63%	0.63	29%	0.285	S	S	*	.	S	Bend	trans	-96.3	-20.7	-174	-53.5	-52.6	175.7	-165.5	0	114.3	L67 E87 K88	L67-K90 PolarHBondContact O-N 3.05Å; E87-K90 PolarHBondContact O-NZ 3.28Å; K88-K90 WeakPolarHBondContact O-CE 3.49Å
91	A	98.3	Very high	98.3	Very high	34 Å²	34	53.8 Å²	53.8	28%	0.281	27%	0.268	S	S	.	.	S	Bend	trans	-125.8	-3.1	-176	0	0	0	0	0	114.3	N68 A70 R93	N68-A91 WeakPolarHBondContact O-CB 3.37Å; A70-A91 CarbonylContact O-C 3.19Å; A91-R93 PolarHBondContact O-N 2.79Å
92	L	98.8	Very high	98.2	Very high	12 Å²	12	57.9 Å²	57.9	6%	0.063	29%	0.286	C	S	.	.			trans	-65.8	133.4	-172	-172.1	65.9	0	0	0	110.8	A70 A73 F89 I94 I95 I115	A70-L92 WeakPolarHBondContact O-CA 3.41Å; A70-L92 PolarHBondContact O-N 3.29Å; A70-L92 VanDerWaalsContact O-N 3.07Å; A73-L92 HydrophobicContact CB-CD1 3.82Å; F89-L92 HydrophobicContact CB-CB 3.61Å; F89-L92 HydrophobicContact CB-CD2 4Å; F89-L92 HydrophobicContact CB-CG 4.47Å; F89-L92 HydrophobicContact CD1-CB 4.17Å; F89-L92 HydrophobicContact CD1-CD2 3.85Å; F89-L92 HydrophobicContact CD1-CG 4.47Å; F89-L92 HydrophobicContact CD2-CD2 4.11Å; F89-L92 HydrophobicContact CE1-CD2 4.31Å; F89-L92 HydrophobicContact CG-CB 4.11Å; F89-L92 HydrophobicContact CG-CD2 3.72Å; L92-I94 WeakPolarHBondContact CD1-O 3.38Å; L92-I95 HydrophobicContact CD2-CD1 3.9Å; L92-I95 HydrophobicContact CD2-CG1 3.73Å; L92-I95 HydrophobicContact CG-CG1 4.35Å; L92-I115 HydrophobicContact CB-CD1 4.49Å; L92-I115 HydrophobicContact CD2-CD1 4.25Å; L92-I115 HydrophobicContact CD2-CG2 4.24Å; L92-I115 HydrophobicContact CG-CG2 4.17Å
93	R	98.8	Very high	98.2	Very high	184 Å²	184	58.1 Å²	58.1	69%	0.694	29%	0.285	S	S	*	.			trans	-122.8	-23.4	179.9	-65.1	-170.4	176.2	-163.2	-2.8	113.4	V71 A91 A116	V71-R93 HydrophobicContact CG1-CB 4.38Å; V71-R93 HydrophobicContact CG1-CG 4.26Å; V71-R93 PolarHBondContact O-N 3.13Å; A91-R93 PolarHBondContact O-N 2.79Å; R93-A116 PolarHBondContact O-N 3.07Å
94	I	98.9	Very high	98.2	Very high	65 Å²	65	54 Å²	54	33%	0.333	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	136.9	-178	-172.9	169.2	0	0	0	111.2	V71 G72 A73 L92 V96 A116	V71-I94 PolarHBondContact O-N 2.97Å; G72-I94 CarbonylContact C-O 3.59Å; G72-I94 WeakPolarHBondContact CA-O 3.43Å; A73-I94 PolarHBondContact N-O 3.32Å; L92-I94 WeakPolarHBondContact CD1-O 3.38Å; I94-V96 HydrophobicContact CD1-CG2 4.03Å; I94-V96 HydrophobicContact CG1-CG2 4.06Å; I94-A116 CarbonylContact C-O 3.35Å; I94-A116 VanDerWaalsContact CA-O 3.31Å; I94-A116 WeakPolarHBondContact CA-O 3.34Å; I94-A116 HydrophobicContact CG1-CB 4.4Å
95	I	98.9	Very high	98.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.6	166.8	-59.2	165.5	0	0	0	107.6	A73 M75 L81 L86 L92 I105 I115 A116 V117 C118	A73-I95 HydrophobicContact CB-CG1 4.28Å; A73-I95 CarbonylContact O-C 3.53Å; A73-I95 WeakPolarHBondContact O-CA 3.31Å; M75-I95 HydrophobicContact CG-CG2 3.87Å; M75-I95 HydrophobicContact SD-CG2 3.6Å; L81-I95 HydrophobicContact CD1-CD1 3.91Å; L86-I95 HydrophobicContact CD2-CD1 3.57Å; L92-I95 HydrophobicContact CD2-CD1 3.9Å; L92-I95 HydrophobicContact CD2-CG1 3.73Å; L92-I95 HydrophobicContact CG-CG1 4.35Å; I95-I105 HydrophobicContact CG2-CD1 3.7Å; I95-I115 HydrophobicContact CD1-CG2 3.78Å; I95-I115 HydrophobicContact CG1-CG2 3.81Å; I95-A116 PolarHBondContact N-O 2.85Å; I95-V117 CarbonylContact O-C 3.56Å; I95-V117 WeakPolarHBondContact O-CA 3.29Å; I95-C118 PolarHBondContact O-N 3.15Å
96	V	98.9	Very high	98.1	Very high	37 Å²	37	49.4 Å²	49.4	22%	0.224	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	115.4	172.4	-172.2	0	0	0	0	109	A73 L74 M75 I94 I98 C118	A73-V96 PolarHBondContact O-N 2.91Å; L74-V96 WeakPolarHBondContact CA-O 3.41Å; L74-V96 HydrophobicContact CD2-CB 3.73Å; L74-V96 HydrophobicContact CD2-CG1 4.45Å; L74-V96 HydrophobicContact CD2-CG2 4.2Å; M75-V96 PolarHBondContact N-O 3.04Å; M75-V96 VanDerWaalsContact N-O 3.13Å; I94-V96 HydrophobicContact CD1-CG2 4.03Å; I94-V96 HydrophobicContact CG1-CG2 4.06Å; V96-I98 PolarHBondContact O-N 2.71Å; V96-C118 HydrophobicContact CG1-CB 4.35Å; V96-C118 HydrophobicContact CG2-CB 4.28Å
97	R	98.6	Very high	98.1	Very high	6 Å²	6	53.1 Å²	53.1	2%	0.023	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	115.1	168.8	-83.8	-69.2	-64.3	96.8	2	109.9	M75 Y76 G99 G101 F102 N104 I105 C118 N119 V120	M75-R97 HydrophobicContact CG-CG 4.49Å; M75-R97 WeakPolarHBondContact O-CA 3.45Å; M75-R97 PolarHBondContact O-NH1 2.71Å; Y76-R97 WeakPolarHBondContact O-CD 3.42Å; Y76-R97 PolarHBondContact O-NE 2.69Å; Y76-R97 PolarHBondContact O-NH1 3.38Å; Y76-R97 VanDerWaalsContact O-NH1 3.08Å; R97-G99 VanDerWaalsContact C-N 3.26Å; R97-G99 PolarHBondContact O-N 2.74Å; R97-G101 PolarHBondContact NE-O 2.93Å; R97-G101 PolarHBondContact NH2-O 3.28Å; R97-F102 HydrophobicContact CG-CB 4.31Å; R97-N104 WeakPolarHBondContact CD-OD1 3.29Å; R97-N104 PolarHBondContact NE-OD1 3.2Å; R97-N104 VanDerWaalsContact NE-OD1 3.08Å; R97-I105 HydrophobicContact CG-CD1 3.45Å; R97-I105 VanDerWaalsContact CG-CD1 3.45Å; R97-C118 PolarHBondContact N-O 2.88Å; R97-N119 HydrophobicContact CB-CB 4.35Å; R97-N119 WeakPolarHBondContact O-CA 3.39Å; R97-V120 PolarHBondContact O-N 3.02Å
98	I	98.5	Very high	98.1	Very high	46 Å²	46	56.3 Å²	56.3	24%	0.236	28%	0.282	C	S	.	.	S	Bend	trans	-74.7	85.9	167.6	-52.7	172.9	0	0	0	107.4	L32 L74 M75 Y76 V96	L32-I98 HydrophobicContact CD1-CD1 4.12Å; L74-I98 HydrophobicContact CB-CD1 4.1Å; M75-I98 PolarHBondContact O-N 2.94Å; Y76-I98 HydrophobicContact CD1-CB 3.96Å; Y76-I98 HydrophobicContact CD1-CG2 4.09Å; Y76-I98 HydrophobicContact CE1-CB 3.76Å; Y76-I98 HydrophobicContact CE1-CD1 4.21Å; Y76-I98 HydrophobicContact CE1-CG2 3.47Å; Y76-I98 VanDerWaalsContact CE1-CG2 3.47Å; Y76-I98 HydrophobicContact CE2-CD1 3.92Å; V96-I98 PolarHBondContact O-N 2.71Å
99	G	96.4	Very high	98.1	Very high	22 Å²	22	53.3 Å²	53.3	23%	0.227	27%	0.27	C	S	.	.	S	Bend	trans	145.4	172.9	-172.7	0	0	0	0	0	111.7	R97 N119 V120	R97-G99 VanDerWaalsContact C-N 3.26Å; R97-G99 PolarHBondContact O-N 2.74Å; G99-N119 WeakPolarHBondContact O-CB 3.47Å; G99-V120 CarbonylContact C-O 3.59Å; G99-V120 PolarHBondContact O-N 3.05Å
100	S	96.1	Very high	98.1	Very high	66 Å²	66	52.6 Å²	52.6	46%	0.462	27%	0.267	S	S	.	.	S	Bend	trans	-83.5	-49.7	-174.6	55.8	0	0	0	0	113.5	N119	S100-N119 PolarHBondContact O-ND2 3.41Å
101	G	94.9	Very high	98.1	Very high	14 Å²	14	48.1 Å²	48.1	14%	0.144	26%	0.261	C	S	.	.			trans	-83.9	148.6	-178.9	0	0	0	0	0	113.3	R97	R97-G101 PolarHBondContact NE-O 2.93Å; R97-G101 PolarHBondContact NH2-O 3.28Å
102	F	97.6	Very high	98.1	Very high	87 Å²	87	51.4 Å²	51.4	38%	0.382	27%	0.274	S	S	.	.			trans	-132.2	17.5	-170.5	49.3	-100	0	0	0	111.7	R97 N104 I105 I107 N119	R97-F102 HydrophobicContact CG-CB 4.31Å; F102-N104 PolarHBondContact O-N 3.05Å; F102-I105 PolarHBondContact O-N 2.99Å; F102-I105 VanDerWaalsContact O-N 3.12Å; F102-I107 HydrophobicContact CD2-CD1 4.09Å; F102-I107 HydrophobicContact CD2-CG2 3.97Å; F102-I107 HydrophobicContact CE2-CD1 3.83Å; F102-N119 HydrophobicContact CD1-CB 4.4Å
103	D	97.6	Very high	98.1	Very high	64 Å²	64	54.1 Å²	54.1	34%	0.342	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.1	178.6	48	-67.3	0	0	0	113.4	I105 L239 R266	D103-I105 PolarHBondContact O-N 3.36Å; D103-L239 HydrophobicContact CB-CB 4.08Å; D103-R266 IonicContact OD1-CZ 2.68Å; D103-R266 IonicContact OD1-NE 3.07Å; D103-R266 PolarHBondContact OD1-NE 3.41Å; D103-R266 IonicContact OD1-NH2 3.21Å; D103-R266 VanDerWaalsContact OD2-CD 3.27Å; D103-R266 WeakPolarHBondContact OD2-CD 3.49Å; D103-R266 IonicContact OD2-NE 2.7Å; D103-R266 PolarHBondContact OD2-NE 2.8Å
104	N	98.3	Very high	98.1	Very high	12 Å²	12	48.1 Å²	48.1	6%	0.064	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	8.6	172.7	66.6	-40.6	0	0	0	113.9	M75 Y76 I79 T80 L81 R97 F102	M75-N104 VanDerWaalsContact CE-ND2 3.28Å; M75-N104 WeakPolarHBondContact CE-ND2 3.11Å; Y76-N104 PolarHBondContact O-ND2 2.94Å; I79-N104 PolarHBondContact O-ND2 3.05Å; T80-N104 CarbonylContact C-O 3.6Å; T80-N104 VanDerWaalsContact CA-O 3.31Å; T80-N104 WeakPolarHBondContact CA-O 3.43Å; L81-N104 PolarHBondContact N-O 3.28Å; R97-N104 WeakPolarHBondContact CD-OD1 3.29Å; R97-N104 PolarHBondContact NE-OD1 3.2Å; R97-N104 VanDerWaalsContact NE-OD1 3.08Å; F102-N104 PolarHBondContact O-N 3.05Å
105	I	98.8	Very high	98.1	Very high	9 Å²	9	45.4 Å²	45.4	5%	0.046	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-129.1	130.3	175.7	-56.3	169.4	0	0	0	108.3	M75 I95 R97 F102 D103 I107 V117	M75-I105 HydrophobicContact CE-CD1 4.11Å; M75-I105 HydrophobicContact CE-CG1 3.83Å; M75-I105 HydrophobicContact SD-CD1 3.72Å; M75-I105 HydrophobicContact SD-CG1 3.96Å; I95-I105 HydrophobicContact CG2-CD1 3.7Å; R97-I105 HydrophobicContact CG-CD1 3.45Å; R97-I105 VanDerWaalsContact CG-CD1 3.45Å; F102-I105 PolarHBondContact O-N 2.99Å; F102-I105 VanDerWaalsContact O-N 3.12Å; D103-I105 PolarHBondContact O-N 3.36Å; I105-I107 HydrophobicContact CB-CG2 4.28Å; I105-I107 HydrophobicContact CG2-CG2 4.26Å; I105-I107 PolarHBondContact O-N 3.26Å; I105-V117 HydrophobicContact CD1-CG1 3.93Å; I105-V117 HydrophobicContact CG2-CG2 4.13Å
106	D	98.4	Very high	98.1	Very high	60 Å²	60	47.9 Å²	47.9	32%	0.321	29%	0.291	S	S	.	.			trans	-71.3	84.3	165.6	-176.6	-10.7	0	0	0	109.9	L81 L86 K108 S109 A110	L81-D106 PolarHBondContact O-N 2.95Å; L86-D106 HydrophobicContact CD1-CB 4.43Å; D106-K108 PolarHBondContact O-N 3.46Å; D106-K108 PolarHBondContact OD1-N 2.86Å; D106-S109 VanDerWaalsContact CG-CB 3.41Å; D106-S109 VanDerWaalsContact CG-OG 3.22Å; D106-S109 PolarHBondContact O-N 3.23Å; D106-S109 PolarHBondContact OD1-N 3.4Å; D106-S109 PolarHBondContact OD1-OG 2.68Å; D106-S109 WeakPolarHBondContact OD2-CB 3.37Å; D106-S109 PolarHBondContact OD2-OG 3.13Å; D106-A110 WeakPolarHBondContact O-CB 3.18Å; D106-A110 PolarHBondContact O-N 2.83Å
107	I	98.3	Very high	98.1	Very high	79 Å²	79	48.2 Å²	48.2	41%	0.405	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-24.3	-176.5	63.5	172	0	0	0	113	F102 I105 G111 V117	F102-I107 HydrophobicContact CD2-CD1 4.09Å; F102-I107 HydrophobicContact CD2-CG2 3.97Å; F102-I107 HydrophobicContact CE2-CD1 3.83Å; I105-I107 HydrophobicContact CB-CG2 4.28Å; I105-I107 HydrophobicContact CG2-CG2 4.26Å; I105-I107 PolarHBondContact O-N 3.26Å; I107-G111 PolarHBondContact O-N 3.24Å; I107-V117 HydrophobicContact CG2-CB 4.21Å; I107-V117 HydrophobicContact CG2-CG1 4.02Å; I107-V117 HydrophobicContact CG2-CG2 4.23Å
108	K	98.1	Very high	98.1	Very high	157 Å²	157	50.5 Å²	50.5	68%	0.683	31%	0.309	S	S	*	.	H	α-helix	trans	-73.4	-49.8	177.9	-175.3	180	178.1	-175.5	0	109.5	D106 A110 G111 D112	D106-K108 PolarHBondContact O-N 3.46Å; D106-K108 PolarHBondContact OD1-N 2.86Å; K108-A110 VanDerWaalsContact C-N 3.31Å; K108-A110 PolarHBondContact O-N 3.09Å; K108-G111 PolarHBondContact O-N 2.84Å; K108-D112 PolarHBondContact O-N 2.87Å
109	S	98.6	Very high	98.1	Very high	6 Å²	6	51 Å²	51	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-63.8	-36.2	174.7	-66.3	0	0	0	0	112.2	R83 D106 G111 D112 L113	R83-S109 WeakPolarHBondContact CB-OG 3.37Å; R83-S109 WeakPolarHBondContact CD-OG 3.39Å; R83-S109 PolarHBondContact NH1-OG 2.74Å; D106-S109 VanDerWaalsContact CG-CB 3.41Å; D106-S109 VanDerWaalsContact CG-OG 3.22Å; D106-S109 PolarHBondContact O-N 3.23Å; D106-S109 PolarHBondContact OD1-N 3.4Å; D106-S109 PolarHBondContact OD1-OG 2.68Å; D106-S109 WeakPolarHBondContact OD2-CB 3.37Å; D106-S109 PolarHBondContact OD2-OG 3.13Å; S109-G111 VanDerWaalsContact C-N 3.34Å; S109-G111 PolarHBondContact O-N 2.94Å; S109-D112 PolarHBondContact O-N 2.83Å; S109-L113 WeakPolarHBondContact O-CB 3.44Å; S109-L113 VanDerWaalsContact O-CG 3.26Å; S109-L113 WeakPolarHBondContact O-CG 3.45Å; S109-L113 PolarHBondContact O-N 3.3Å
110	A	98.7	Very high	98.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.5	-46.1	172.3	0	0	0	0	0	111.4	L86 D106 K108 L113 G114 I115 V117	L86-A110 HydrophobicContact CD1-CB 3.96Å; D106-A110 WeakPolarHBondContact O-CB 3.18Å; D106-A110 PolarHBondContact O-N 2.83Å; K108-A110 VanDerWaalsContact C-N 3.31Å; K108-A110 PolarHBondContact O-N 3.09Å; A110-L113 CarbonylContact O-C 3.57Å; A110-L113 PolarHBondContact O-N 2.99Å; A110-G114 PolarHBondContact O-N 3.01Å; A110-I115 CarbonylContact C-O 3.5Å; A110-I115 HydrophobicContact CB-CB 4.17Å; A110-I115 HydrophobicContact CB-CG2 4.48Å; A110-I115 WeakPolarHBondContact O-CA 3.34Å; A110-I115 WeakPolarHBondContact O-CB 3.49Å; A110-I115 PolarHBondContact O-N 3.18Å; A110-V117 HydrophobicContact CB-CG2 3.69Å
111	G	98.6	Very high	98.1	Very high	50 Å²	50	51.8 Å²	51.8	52%	0.515	31%	0.31	S	S	.	.	H	α-helix	trans	-59.6	-45.3	174.9	0	0	0	0	0	113.4	I107 K108 S109 L113 G114	I107-G111 PolarHBondContact O-N 3.24Å; K108-G111 PolarHBondContact O-N 2.84Å; S109-G111 VanDerWaalsContact C-N 3.34Å; S109-G111 PolarHBondContact O-N 2.94Å; G111-L113 PolarHBondContact O-N 3.05Å; G111-G114 PolarHBondContact O-N 3.43Å
112	D	98.6	Very high	98.1	Very high	104 Å²	104	54.5 Å²	54.5	56%	0.556	33%	0.331	S	S	*	.	H	α-helix	trans	-59.4	-33.9	176.1	-68	-19.9	0	0	0	112.3	R83 K108 S109 G114	R83-D112 IonicContact CZ-OD2 3.56Å; R83-D112 IonicContact NH1-OD2 3.82Å; R83-D112 PolarHBondContact NH1-OD2 2.86Å; R83-D112 IonicContact NH2-OD2 3.41Å; K108-D112 PolarHBondContact O-N 2.87Å; S109-D112 PolarHBondContact O-N 2.83Å; D112-G114 VanDerWaalsContact C-N 3.3Å
113	L	98.6	Very high	97.5	Very high	68 Å²	68	53.3 Å²	53.3	36%	0.356	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	1	178.5	-66	169.9	0	0	0	113.3	L86 E87 S109 A110 G111 I115	L86-L113 HydrophobicContact CB-CD1 3.59Å; E87-L113 HydrophobicContact CG-CD1 3.98Å; E87-L113 HydrophobicContact CG-CD2 4.12Å; S109-L113 WeakPolarHBondContact O-CB 3.44Å; S109-L113 VanDerWaalsContact O-CG 3.26Å; S109-L113 WeakPolarHBondContact O-CG 3.45Å; S109-L113 PolarHBondContact O-N 3.3Å; A110-L113 CarbonylContact O-C 3.57Å; A110-L113 PolarHBondContact O-N 2.99Å; G111-L113 PolarHBondContact O-N 3.05Å; L113-I115 VanDerWaalsContact C-N 3.34Å; L113-I115 HydrophobicContact CB-CD1 3.94Å; L113-I115 HydrophobicContact CB-CG1 4.21Å; L113-I115 HydrophobicContact CD1-CD1 4.39Å
114	G	98.6	Very high	97.5	Very high	58 Å²	58	53.3 Å²	53.3	60%	0.598	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	22.6	-178.6	0	0	0	0	0	114.2	A110 G111 D112	A110-G114 PolarHBondContact O-N 3.01Å; G111-G114 PolarHBondContact O-N 3.43Å; D112-G114 VanDerWaalsContact C-N 3.3Å
115	I	98.9	Very high	97.5	Very high	9 Å²	9	53.9 Å²	53.9	5%	0.046	35%	0.347	C	S	.	.			trans	-100.9	114.9	178.8	-56.3	165.1	0	0	0	108.7	L86 L92 I95 A110 L113	L86-I115 HydrophobicContact CB-CD1 4.49Å; L86-I115 HydrophobicContact CD2-CD1 4.25Å; L92-I115 HydrophobicContact CB-CD1 4.49Å; L92-I115 HydrophobicContact CD2-CD1 4.25Å; L92-I115 HydrophobicContact CD2-CG2 4.24Å; L92-I115 HydrophobicContact CG-CG2 4.17Å; I95-I115 HydrophobicContact CD1-CG2 3.78Å; I95-I115 HydrophobicContact CG1-CG2 3.81Å; A110-I115 CarbonylContact C-O 3.5Å; A110-I115 HydrophobicContact CB-CB 4.17Å; A110-I115 HydrophobicContact CB-CG2 4.48Å; A110-I115 WeakPolarHBondContact O-CA 3.34Å; A110-I115 WeakPolarHBondContact O-CB 3.49Å; A110-I115 PolarHBondContact O-N 3.18Å; L113-I115 VanDerWaalsContact C-N 3.34Å; L113-I115 HydrophobicContact CB-CD1 3.94Å; L113-I115 HydrophobicContact CB-CG1 4.21Å; L113-I115 HydrophobicContact CD1-CD1 4.39Å
116	A	98.9	Very high	97.5	Very high	52 Å²	52	58 Å²	58	43%	0.43	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	140.4	173	0	0	0	0	0	110.7	R93 I94 I95	R93-A116 PolarHBondContact O-N 3.07Å; I94-A116 CarbonylContact C-O 3.35Å; I94-A116 VanDerWaalsContact CA-O 3.31Å; I94-A116 WeakPolarHBondContact CA-O 3.34Å; I94-A116 HydrophobicContact CG1-CB 4.4Å; I95-A116 PolarHBondContact N-O 2.85Å
117	V	98.8	Very high	97.5	Very high	43 Å²	43	60.6 Å²	60.6	26%	0.261	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.9	173	-176.1	0	0	0	0	109.5	I95 I105 I107 A110	I95-V117 CarbonylContact O-C 3.56Å; I95-V117 WeakPolarHBondContact O-CA 3.29Å; I105-V117 HydrophobicContact CD1-CG1 3.93Å; I105-V117 HydrophobicContact CG2-CG2 4.13Å; I107-V117 HydrophobicContact CG2-CB 4.21Å; I107-V117 HydrophobicContact CG2-CG1 4.02Å; I107-V117 HydrophobicContact CG2-CG2 4.23Å; A110-V117 HydrophobicContact CB-CG2 3.69Å
118	C	98.8	Very high	97.5	Very high	55 Å²	55	58.8 Å²	58.8	37%	0.372	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	159.6	176.6	-61.1	0	0	0	0	110.5	I95 V96 R97	I95-C118 PolarHBondContact O-N 3.15Å; V96-C118 HydrophobicContact CG1-CB 4.35Å; V96-C118 HydrophobicContact CG2-CB 4.28Å; R97-C118 PolarHBondContact N-O 2.88Å
119	N	98.4	Very high	97.6	Very high	57 Å²	57	51.3 Å²	51.3	31%	0.305	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	174.8	175.8	69	-18.5	0	0	0	111.2	R97 G99 S100 F102 P121	R97-N119 HydrophobicContact CB-CB 4.35Å; R97-N119 WeakPolarHBondContact O-CA 3.39Å; G99-N119 WeakPolarHBondContact O-CB 3.47Å; S100-N119 PolarHBondContact O-ND2 3.41Å; F102-N119 HydrophobicContact CD1-CB 4.4Å; N119-P121 WeakPolarHBondContact O-CD 3.39Å
120	V	98.1	Very high	97.6	Very high	60 Å²	60	55.1 Å²	55.1	36%	0.364	36%	0.356	S	S	.	.			trans	-116.3	81.5	174.3	-168.6	0	0	0	0	109.2	R97 G99 A122 A123	R97-V120 PolarHBondContact O-N 3.02Å; G99-V120 CarbonylContact C-O 3.59Å; G99-V120 PolarHBondContact O-N 3.05Å; V120-A122 VanDerWaalsContact C-N 3.3Å; V120-A122 PolarHBondContact O-N 3.36Å; V120-A123 HydrophobicContact CB-CB 4.5Å; V120-A123 HydrophobicContact CG1-CB 3.73Å
121	P	94.8	Very high	97.6	Very high	43 Å²	43	57.8 Å²	57.8	28%	0.279	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-12	-164.6	29.2	-36.7	0	0	0	115.3	N119 R184	N119-P121 WeakPolarHBondContact O-CD 3.39Å; P121-R184 WeakPolarHBondContact O-CD 3.49Å
122	A	94.5	Very high	97.6	Very high	72 Å²	72	55.4 Å²	55.4	60%	0.595	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-9.1	-173.7	0	0	0	0	0	114.4	V120 S124	V120-A122 VanDerWaalsContact C-N 3.3Å; V120-A122 PolarHBondContact O-N 3.36Å; A122-S124 VanDerWaalsContact C-N 3.31Å; A122-S124 PolarHBondContact O-N 3.12Å
123	A	85.9	Confident	97.6	Very high	62 Å²	62	50.9 Å²	50.9	51%	0.512	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-27.2	-164.6	0	0	0	0	0	115.5	V120	V120-A123 HydrophobicContact CB-CB 4.5Å; V120-A123 HydrophobicContact CG1-CB 3.73Å
124	S	96.9	Very high	97.7	Very high	64 Å²	64	50.8 Å²	50.8	45%	0.448	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.7	28.1	-172.1	-50.1	0	0	0	0	112.9	A122 E127 T128	A122-S124 VanDerWaalsContact C-N 3.31Å; A122-S124 PolarHBondContact O-N 3.12Å; S124-E127 VanDerWaalsContact CA-OE2 3.27Å; S124-E127 WeakPolarHBondContact CA-OE2 3.42Å; S124-T128 WeakPolarHBondContact O-CB 3.3Å; S124-T128 PolarHBondContact O-N 3.37Å; S124-T128 PolarHBondContact O-OG1 3.27Å
125	V	98.6	Very high	97.7	Very high	24 Å²	24	50.1 Å²	50.1	15%	0.145	31%	0.311	C	S	.	.	H	α-helix	trans	-61.6	-47.7	-175.3	171.9	0	0	0	0	111.2	A129 R184 V185 A188	V125-A129 WeakPolarHBondContact O-CB 3.46Å; V125-A129 PolarHBondContact O-N 2.94Å; V125-A129 VanDerWaalsContact O-N 3.16Å; V125-R184 HydrophobicContact CB-CB 4.47Å; V125-R184 HydrophobicContact CG1-CB 3.81Å; V125-R184 HydrophobicContact CG2-CB 3.75Å; V125-R184 HydrophobicContact CG2-CG 4.44Å; V125-V185 HydrophobicContact CG1-CG2 4.45Å; V125-A188 HydrophobicContact CG1-CB 4.24Å
126	E	98.7	Very high	97.7	Very high	94 Å²	94	49.7 Å²	49.7	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-76.1	-38.8	-176.3	-59.3	-67.9	-178	0	0	110.6	A129 D130 R192	E126-A129 PolarHBondContact O-N 2.97Å; E126-D130 WeakPolarHBondContact O-CB 3.41Å; E126-D130 VanDerWaalsContact O-CG 3.25Å; E126-D130 PolarHBondContact O-N 3.3Å; E126-R192 IonicContact OE2-CZ 3.93Å; E126-R192 IonicContact OE2-NH1 3.26Å; E126-R192 PolarHBondContact OE2-NH1 2.8Å; E126-R192 IonicContact OE2-NH2 3.97Å; E126-R192 PolarHBondContact OE2-NH2 2.82Å
127	E	98.8	Very high	97.7	Very high	116 Å²	116	49.4 Å²	49.4	54%	0.542	30%	0.3	S	S	.	.	H	α-helix	trans	-60.9	-46.4	176	-68.3	75.1	-171.3	0	0	111.4	S124 A129 D130 S131	S124-E127 VanDerWaalsContact CA-OE2 3.27Å; S124-E127 WeakPolarHBondContact CA-OE2 3.42Å; E127-A129 VanDerWaalsContact C-N 3.32Å; E127-A129 PolarHBondContact O-N 2.94Å; E127-D130 PolarHBondContact O-N 3.17Å; E127-S131 WeakPolarHBondContact O-CB 3.47Å; E127-S131 PolarHBondContact O-N 3.27Å; E127-S131 PolarHBondContact O-OG 2.81Å
128	T	98.8	Very high	97.7	Very high	41 Å²	41	49 Å²	49	25%	0.252	30%	0.296	S	S	.	.	H	α-helix	trans	-65.1	-37.2	175.5	-56.3	0	0	0	0	111.3	S124 T132 V185	S124-T128 WeakPolarHBondContact O-CB 3.3Å; S124-T128 PolarHBondContact O-N 3.37Å; S124-T128 PolarHBondContact O-OG1 3.27Å; T128-T132 WeakPolarHBondContact O-CB 3.43Å; T128-T132 PolarHBondContact O-N 2.96Å; T128-T132 PolarHBondContact O-OG1 2.97Å; T128-V185 HydrophobicContact CG2-CG1 3.82Å; T128-V185 HydrophobicContact CG2-CG2 4.24Å
129	A	98.9	Very high	97.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.5	-42.5	176.5	0	0	0	0	0	112.1	V125 E126 E127 T132 L133 V185 A188 V189	V125-A129 WeakPolarHBondContact O-CB 3.46Å; V125-A129 PolarHBondContact O-N 2.94Å; V125-A129 VanDerWaalsContact O-N 3.16Å; E126-A129 PolarHBondContact O-N 2.97Å; E127-A129 VanDerWaalsContact C-N 3.32Å; E127-A129 PolarHBondContact O-N 2.94Å; A129-T132 WeakPolarHBondContact O-CB 3.42Å; A129-T132 PolarHBondContact O-N 3.49Å; A129-L133 VanDerWaalsContact O-CD2 3.3Å; A129-L133 WeakPolarHBondContact O-CD2 3.32Å; A129-L133 PolarHBondContact O-N 3.31Å; A129-V185 HydrophobicContact CB-CG1 4.45Å; A129-A188 HydrophobicContact CB-CB 3.59Å; A129-V189 HydrophobicContact CB-CG2 3.7Å
130	D	98.9	Very high	97.7	Very high	85 Å²	85	43.8 Å²	43.8	46%	0.455	27%	0.265	S	S	.	.	H	α-helix	trans	-62.6	-45.4	176.4	-72	-13.4	0	0	0	111.1	E126 E127 T132 L133 C134 R192	E126-D130 WeakPolarHBondContact O-CB 3.41Å; E126-D130 VanDerWaalsContact O-CG 3.25Å; E126-D130 PolarHBondContact O-N 3.3Å; E127-D130 PolarHBondContact O-N 3.17Å; D130-T132 VanDerWaalsContact C-N 3.34Å; D130-T132 PolarHBondContact O-N 3.01Å; D130-L133 PolarHBondContact O-N 3.06Å; D130-C134 WeakPolarHBondContact O-CB 3.5Å; D130-C134 PolarHBondContact O-N 3.07Å; D130-R192 IonicContact OD1-CZ 3.69Å; D130-R192 IonicContact OD1-NE 3.69Å; D130-R192 PolarHBondContact OD1-NE 2.86Å; D130-R192 IonicContact OD1-NH2 3.52Å; D130-R192 PolarHBondContact OD1-NH2 3.46Å; D130-R192 IonicContact OD2-NH2 3.17Å
131	S	98.9	Very high	97.7	Very high	56 Å²	56	46 Å²	46	39%	0.392	27%	0.267	S	S	.	.	H	α-helix	trans	-62.3	-39.8	174	-68.2	0	0	0	0	112.3	E127 L133 C134 H135	E127-S131 WeakPolarHBondContact O-CB 3.47Å; E127-S131 PolarHBondContact O-N 3.27Å; E127-S131 PolarHBondContact O-OG 2.81Å; S131-L133 PolarHBondContact O-N 3.48Å; S131-C134 WeakPolarHBondContact O-CB 3.35Å; S131-C134 PolarHBondContact O-N 3.1Å; S131-H135 PolarHBondContact O-CD2 3.37Å; S131-H135 PolarHBondContact O-N 2.97Å
132	T	98.9	Very high	97.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-48	174.5	-56.1	0	0	0	0	111	T128 A129 D130 C134 H135 I136 V189 T234 H236 V262 T264	T128-T132 WeakPolarHBondContact O-CB 3.43Å; T128-T132 PolarHBondContact O-N 2.96Å; T128-T132 PolarHBondContact O-OG1 2.97Å; A129-T132 WeakPolarHBondContact O-CB 3.42Å; A129-T132 PolarHBondContact O-N 3.49Å; D130-T132 VanDerWaalsContact C-N 3.34Å; D130-T132 PolarHBondContact O-N 3.01Å; T132-C134 VanDerWaalsContact C-N 3.3Å; T132-C134 PolarHBondContact O-N 2.93Å; T132-H135 WeakPolarHBondContact O-CB 3.19Å; T132-H135 PolarHBondContact O-N 3.49Å; T132-I136 HydrophobicContact CG2-CD1 3.94Å; T132-I136 HydrophobicContact CG2-CG1 4.47Å; T132-I136 WeakPolarHBondContact O-CG1 3.34Å; T132-I136 PolarHBondContact O-N 3Å; T132-V189 HydrophobicContact CG2-CG1 4.26Å; T132-V189 HydrophobicContact CG2-CG2 3.95Å; T132-T234 WeakPolarHBondContact CG2-OG1 3.25Å; T132-H236 VanDerWaalsContact CG2-CE1 3.47Å; T132-H236 WeakPolarHBondContact CG2-CE1 3.32Å; T132-H236 PolarHBondContact OG1-CE1 3.33Å; T132-V262 HydrophobicContact CG2-CG1 4.1Å; T132-T264 PolarHBondContact OG1-OG1 3.3Å; T132-T264 VanDerWaalsContact OG1-OG1 3.04Å
133	L	98.9	Very high	98.1	Very high	10 Å²	10	43.5 Å²	43.5	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-38.4	177.2	-92.2	-59.8	0	0	0	111.3	A129 D130 S131 H135 I136 L137 V189 R192 F196	A129-L133 VanDerWaalsContact O-CD2 3.3Å; A129-L133 WeakPolarHBondContact O-CD2 3.32Å; A129-L133 PolarHBondContact O-N 3.31Å; D130-L133 PolarHBondContact O-N 3.06Å; S131-L133 PolarHBondContact O-N 3.48Å; L133-H135 VanDerWaalsContact C-N 3.33Å; L133-H135 PolarHBondContact O-N 3.5Å; L133-I136 PolarHBondContact O-N 3.2Å; L133-L137 WeakPolarHBondContact O-CB 3.18Å; L133-L137 WeakPolarHBondContact O-CG 3.48Å; L133-L137 PolarHBondContact O-N 3.4Å; L133-V189 HydrophobicContact CD2-CB 4.07Å; L133-V189 HydrophobicContact CD2-CG1 3.79Å; L133-V189 HydrophobicContact CD2-CG2 3.95Å; L133-R192 HydrophobicContact CD1-CB 4.42Å; L133-R192 HydrophobicContact CD2-CB 3.84Å; L133-R192 HydrophobicContact CG-CB 3.88Å; L133-F196 HydrophobicContact CD1-CD2 4.48Å; L133-F196 HydrophobicContact CD1-CE2 4.45Å
134	C	98.9	Very high	98.6	Very high	66 Å²	66	44.2 Å²	44.2	45%	0.446	25%	0.245	S	C	.	.	H	α-helix	trans	-56.8	-47	172.9	-174.7	0	0	0	0	111.3	D130 S131 T132 L137 N138	D130-C134 WeakPolarHBondContact O-CB 3.5Å; D130-C134 PolarHBondContact O-N 3.07Å; S131-C134 WeakPolarHBondContact O-CB 3.35Å; S131-C134 PolarHBondContact O-N 3.1Å; T132-C134 VanDerWaalsContact C-N 3.3Å; T132-C134 PolarHBondContact O-N 2.93Å; C134-L137 PolarHBondContact O-N 2.86Å; C134-N138 VanDerWaalsContact O-CB 3.3Å; C134-N138 WeakPolarHBondContact O-CB 3.43Å; C134-N138 PolarHBondContact O-N 3.35Å; C134-N138 PolarHBondContact O-ND2 3.23Å; C134-N138 VanDerWaalsContact O-ND2 3.09Å; C134-N138 PolarHBondContact SG-ND2 3.05Å
135	H	98.9	Very high	98.6	Very high	44 Å²	44	43 Å²	43	20%	0.204	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-47.2	175.8	-74.6	-53.8	0	0	0	112.8	S131 T132 L133 L137 N138 L139 V262 A288	S131-H135 PolarHBondContact O-CD2 3.37Å; S131-H135 PolarHBondContact O-N 2.97Å; T132-H135 WeakPolarHBondContact O-CB 3.19Å; T132-H135 PolarHBondContact O-N 3.49Å; L133-H135 VanDerWaalsContact C-N 3.33Å; L133-H135 PolarHBondContact O-N 3.5Å; H135-L137 PolarHBondContact O-N 3.21Å; H135-N138 PolarHBondContact O-N 2.95Å; H135-L139 WeakPolarHBondContact O-CG 3.44Å; H135-L139 PolarHBondContact O-N 3.28Å; H135-V262 HydrophobicContact CB-CG1 3.94Å; H135-A288 HydrophobicContact CB-CB 3.68Å
136	I	98.9	Very high	98.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-57.1	-50.3	176.2	-67.7	167.9	0	0	0	110.1	T132 L133 N138 L139 Y140 L177 F198 V262	T132-I136 HydrophobicContact CG2-CD1 3.94Å; T132-I136 HydrophobicContact CG2-CG1 4.47Å; T132-I136 WeakPolarHBondContact O-CG1 3.34Å; T132-I136 PolarHBondContact O-N 3Å; L133-I136 PolarHBondContact O-N 3.2Å; I136-N138 VanDerWaalsContact C-N 3.31Å; I136-N138 PolarHBondContact O-N 3.16Å; I136-L139 PolarHBondContact O-N 3.33Å; I136-Y140 HydrophobicContact CG2-CD2 3.92Å; I136-Y140 HydrophobicContact CG2-CE2 4.14Å; I136-Y140 WeakPolarHBondContact O-CD2 3.48Å; I136-Y140 PolarHBondContact O-N 3.4Å; I136-L177 HydrophobicContact CD1-CD1 3.86Å; I136-L177 HydrophobicContact CD1-CD2 4.11Å; I136-F198 HydrophobicContact CG2-CE2 3.96Å; I136-F198 HydrophobicContact CG2-CZ 3.77Å; I136-V262 HydrophobicContact CG1-CB 4.48Å; I136-V262 HydrophobicContact CG1-CG2 3.81Å
137	L	98.9	Very high	98.5	Very high	45 Å²	45	45.4 Å²	45.4	24%	0.236	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-36.6	179.9	-67.2	176.2	0	0	0	111.9	L133 C134 H135 L139 Y140 R141 I172 F196	L133-L137 WeakPolarHBondContact O-CB 3.18Å; L133-L137 WeakPolarHBondContact O-CG 3.48Å; L133-L137 PolarHBondContact O-N 3.4Å; C134-L137 PolarHBondContact O-N 2.86Å; H135-L137 PolarHBondContact O-N 3.21Å; L137-L139 VanDerWaalsContact C-N 3.34Å; L137-L139 PolarHBondContact O-N 3.43Å; L137-Y140 PolarHBondContact O-N 3.44Å; L137-R141 WeakPolarHBondContact O-CA 3.08Å; L137-R141 WeakPolarHBondContact O-CB 3.45Å; L137-R141 VanDerWaalsContact O-CG 3.25Å; L137-R141 WeakPolarHBondContact O-CG 3.32Å; L137-R141 PolarHBondContact O-N 3.2Å; L137-I172 HydrophobicContact CD2-CD1 3.45Å; L137-I172 VanDerWaalsContact CD2-CD1 3.45Å; L137-F196 HydrophobicContact CD1-CE1 3.84Å; L137-F196 HydrophobicContact CD1-CZ 3.79Å; L137-F196 HydrophobicContact CD2-CD1 3.86Å; L137-F196 HydrophobicContact CD2-CE1 3.79Å; L137-F196 HydrophobicContact CD2-CG 4.49Å; L137-F196 HydrophobicContact CD2-CZ 4.38Å; L137-F196 HydrophobicContact CG-CE1 4.45Å
138	N	98.8	Very high	98.4	Very high	34 Å²	34	41.9 Å²	41.9	18%	0.182	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-39.5	173.9	-87.4	-44.2	0	0	0	112.3	C134 H135 I136 R142 A143 T144	C134-N138 VanDerWaalsContact O-CB 3.3Å; C134-N138 WeakPolarHBondContact O-CB 3.43Å; C134-N138 PolarHBondContact O-N 3.35Å; C134-N138 PolarHBondContact O-ND2 3.23Å; C134-N138 VanDerWaalsContact O-ND2 3.09Å; C134-N138 PolarHBondContact SG-ND2 3.05Å; H135-N138 PolarHBondContact O-N 2.95Å; I136-N138 VanDerWaalsContact C-N 3.31Å; I136-N138 PolarHBondContact O-N 3.16Å; N138-R142 WeakPolarHBondContact O-CA 3.23Å; N138-R142 PolarHBondContact O-N 3.09Å; N138-A143 WeakPolarHBondContact OD1-CB 3.2Å; N138-T144 VanDerWaalsContact CG-OG1 3.29Å; N138-T144 PolarHBondContact ND2-OG1 3.18Å; N138-T144 PolarHBondContact OD1-N 3Å; N138-T144 PolarHBondContact OD1-OG1 3.38Å; N138-T144 VanDerWaalsContact OD1-OG1 3.1Å
139	L	98.6	Very high	98.2	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-66	-47.6	174.7	-67.1	177	0	0	0	111.7	H135 I136 L137 W145 F260 V262 A288	H135-L139 WeakPolarHBondContact O-CG 3.44Å; H135-L139 PolarHBondContact O-N 3.28Å; I136-L139 PolarHBondContact O-N 3.33Å; L137-L139 VanDerWaalsContact C-N 3.34Å; L137-L139 PolarHBondContact O-N 3.43Å; L139-W145 HydrophobicContact CD2-CH2 3.55Å; L139-W145 HydrophobicContact CD2-CZ2 4.14Å; L139-W145 HydrophobicContact CD2-CZ3 4.35Å; L139-F260 HydrophobicContact CB-CD1 3.83Å; L139-F260 HydrophobicContact CB-CD2 4.31Å; L139-F260 HydrophobicContact CB-CE1 3.87Å; L139-F260 HydrophobicContact CB-CE2 4.34Å; L139-F260 HydrophobicContact CB-CG 4.04Å; L139-F260 HydrophobicContact CB-CZ 4.11Å; L139-F260 HydrophobicContact CD1-CB 3.89Å; L139-F260 HydrophobicContact CD1-CD1 4Å; L139-F260 HydrophobicContact CD1-CG 4.08Å; L139-F260 HydrophobicContact CD2-CD1 4.24Å; L139-F260 HydrophobicContact CD2-CE1 4.41Å; L139-F260 HydrophobicContact CG-CD1 4.25Å; L139-F260 WeakPolarHBondContact O-CZ 3.41Å; L139-V262 HydrophobicContact CD1-CG2 3.66Å; L139-A288 HydrophobicContact CD1-CB 4Å; L139-A288 HydrophobicContact CD2-CB 4.29Å; L139-A288 HydrophobicContact CG-CB 4.15Å
140	Y	98.8	Very high	98.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-70.7	-33.7	-178	-87.5	-85.6	0	0	0	113.8	I136 L137 A169 A170 I172 E175 F198 C232 F260	I136-Y140 HydrophobicContact CG2-CD2 3.92Å; I136-Y140 HydrophobicContact CG2-CE2 4.14Å; I136-Y140 WeakPolarHBondContact O-CD2 3.48Å; I136-Y140 PolarHBondContact O-N 3.4Å; L137-Y140 PolarHBondContact O-N 3.44Å; Y140-A169 CarbonylContact O-C 3.53Å; Y140-A169 VanDerWaalsContact O-CA 3.31Å; Y140-A169 WeakPolarHBondContact O-CA 3.5Å; Y140-A170 HydrophobicContact CD1-CB 3.95Å; Y140-A170 HydrophobicContact CE1-CB 4.21Å; Y140-A170 PolarHBondContact O-N 3.02Å; Y140-I172 HydrophobicContact CD1-CG1 3.82Å; Y140-I172 HydrophobicContact CD2-CG1 4.5Å; Y140-I172 HydrophobicContact CG-CD1 4.5Å; Y140-I172 HydrophobicContact CG-CG1 3.81Å; Y140-E175 HydrophobicContact CE1-CB 4.35Å; Y140-E175 HydrophobicContact CE1-CG 3.71Å; Y140-E175 VanDerWaalsContact CE1-OE2 3.25Å; Y140-E175 WeakPolarHBondContact CE1-OE2 3.38Å; Y140-E175 PolarHBondContact OH-OE2 2.68Å; Y140-F198 HydrophobicContact CD2-CZ 4.07Å; Y140-F198 AromaticContact CE2-CE1 3.9Å; Y140-F198 HydrophobicContact CE2-CE1 3.9Å; Y140-F198 AromaticContact CE2-CZ 3.65Å; Y140-F198 HydrophobicContact CE2-CZ 3.65Å; Y140-F198 AromaticContact CZ-CE1 3.88Å; Y140-C232 HydrophobicContact CE2-CB 3.93Å; Y140-F260 HydrophobicContact CD1-CE2 4.15Å; Y140-F260 HydrophobicContact CD2-CD2 4.05Å; Y140-F260 HydrophobicContact CD2-CE2 4.08Å; Y140-F260 HydrophobicContact CE1-CD2 4.33Å; Y140-F260 HydrophobicContact CE1-CE2 4.08Å; Y140-F260 AromaticContact CE2-CD2 3.67Å; Y140-F260 HydrophobicContact CE2-CD2 3.67Å; Y140-F260 HydrophobicContact CE2-CE2 4.05Å; Y140-F260 HydrophobicContact CG-CE2 4.14Å; Y140-F260 AromaticContact CZ-CD2 3.82Å
141	R	98.6	Very high	98	Very high	106 Å²	106	51 Å²	51	40%	0.4	26%	0.258	S	S	.	.	H	α-helix	trans	-108.1	-8.8	-173.1	-51	-68.2	68.1	-159.1	-19.4	113.3	L137 A143 A170	L137-R141 WeakPolarHBondContact O-CA 3.08Å; L137-R141 WeakPolarHBondContact O-CB 3.45Å; L137-R141 VanDerWaalsContact O-CG 3.25Å; L137-R141 WeakPolarHBondContact O-CG 3.32Å; L137-R141 PolarHBondContact O-N 3.2Å; R141-A143 PolarHBondContact O-N 2.91Å; R141-A170 PolarHBondContact NH2-O 2.87Å
142	R	98.3	Very high	97.8	Very high	12 Å²	12	54 Å²	54	5%	0.045	27%	0.266	C	S	.	.			trans	59.3	23.4	177.8	-51.5	-171.4	69	80.6	1.3	114.2	N138 T144 W145 L146 S167 A169 C308	N138-R142 WeakPolarHBondContact O-CA 3.23Å; N138-R142 PolarHBondContact O-N 3.09Å; R142-T144 PolarHBondContact O-N 3.03Å; R142-W145 HydrophobicContact CB-CE3 3.85Å; R142-W145 HydrophobicContact CG-CE3 3.83Å; R142-W145 HydrophobicContact CG-CZ3 4.13Å; R142-W145 VanDerWaalsContact NH1-CZ3 3.26Å; R142-W145 PolarHBondContact O-N 2.84Å; R142-L146 HydrophobicContact CB-CD1 4.39Å; R142-L146 HydrophobicContact CB-CG 4.29Å; R142-L146 WeakPolarHBondContact O-CB 3.46Å; R142-L146 VanDerWaalsContact O-CG 3.28Å; R142-L146 WeakPolarHBondContact O-CG 3.46Å; R142-L146 PolarHBondContact O-N 3.44Å; R142-S167 WeakPolarHBondContact CD-O 3.27Å; R142-S167 PolarHBondContact NE-O 2.95Å; R142-S167 VanDerWaalsContact NE-O 3.12Å; R142-A169 HydrophobicContact CG-CB 4.17Å; R142-C308 PolarHBondContact NH2-O 3.44Å
143	A	98.4	Very high	97.7	Very high	51 Å²	51	56.4 Å²	56.4	42%	0.421	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-45.3	-168.9	0	0	0	0	0	112.9	N138 R141 L146 H147	N138-A143 WeakPolarHBondContact OD1-CB 3.2Å; R141-A143 PolarHBondContact O-N 2.91Å; A143-L146 PolarHBondContact O-N 3.46Å; A143-H147 WeakPolarHBondContact O-CB 3.17Å; A143-H147 PolarHBondContact O-N 3.34Å
144	T	97.2	Very high	97.5	Very high	76 Å²	76	58.9 Å²	58.9	47%	0.466	31%	0.307	S	S	.	.	H	α-helix	trans	-59.8	-46.1	174	-55.3	0	0	0	0	112.4	N138 R142 H147 Q148	N138-T144 VanDerWaalsContact CG-OG1 3.29Å; N138-T144 PolarHBondContact ND2-OG1 3.18Å; N138-T144 PolarHBondContact OD1-N 3Å; N138-T144 PolarHBondContact OD1-OG1 3.38Å; N138-T144 VanDerWaalsContact OD1-OG1 3.1Å; R142-T144 PolarHBondContact O-N 3.03Å; T144-H147 PolarHBondContact O-N 3Å; T144-Q148 WeakPolarHBondContact O-CB 3.49Å; T144-Q148 PolarHBondContact O-N 3.38Å
145	W	96.8	Very high	97.4	Very high	38 Å²	38	65.4 Å²	65.4	14%	0.144	32%	0.322	C	S	.	.	H	α-helix	trans	-66.6	-38	179.4	-64.6	-45.2	0	0	0	112.7	L139 R142 Q148 A149 C308	L139-W145 HydrophobicContact CD2-CH2 3.55Å; L139-W145 HydrophobicContact CD2-CZ2 4.14Å; L139-W145 HydrophobicContact CD2-CZ3 4.35Å; R142-W145 HydrophobicContact CB-CE3 3.85Å; R142-W145 HydrophobicContact CG-CE3 3.83Å; R142-W145 HydrophobicContact CG-CZ3 4.13Å; R142-W145 VanDerWaalsContact NH1-CZ3 3.26Å; R142-W145 PolarHBondContact O-N 2.84Å; W145-Q148 PolarHBondContact O-N 3.17Å; W145-A149 WeakPolarHBondContact O-CB 3.11Å; W145-A149 PolarHBondContact O-N 3.4Å; W145-C308 HydrophobicContact CH2-CB 4.35Å; W145-C308 HydrophobicContact CZ2-CB 3.49Å; W145-C308 VanDerWaalsContact CZ2-CB 3.49Å
146	L	97.9	Very high	97.2	Very high	49 Å²	49	65.8 Å²	65.8	26%	0.257	33%	0.327	S	S	.	.	H	α-helix	trans	-64.7	-43.4	174.6	-72.2	171.6	0	0	0	111.4	R142 A143 Q148 A149 L150 V165 A166	R142-L146 HydrophobicContact CB-CD1 4.39Å; R142-L146 HydrophobicContact CB-CG 4.29Å; R142-L146 WeakPolarHBondContact O-CB 3.46Å; R142-L146 VanDerWaalsContact O-CG 3.28Å; R142-L146 WeakPolarHBondContact O-CG 3.46Å; R142-L146 PolarHBondContact O-N 3.44Å; A143-L146 PolarHBondContact O-N 3.46Å; L146-Q148 VanDerWaalsContact C-N 3.33Å; L146-Q148 PolarHBondContact O-N 3.48Å; L146-A149 PolarHBondContact O-N 3.01Å; L146-L150 WeakPolarHBondContact O-CG 3.37Å; L146-L150 PolarHBondContact O-N 3.36Å; L146-V165 HydrophobicContact CD2-CB 4.34Å; L146-V165 HydrophobicContact CD2-CG1 3.77Å; L146-V165 HydrophobicContact CD2-CG2 4Å; L146-V165 WeakPolarHBondContact CD2-O 3.48Å; L146-A166 HydrophobicContact CD1-CB 4.36Å; L146-A166 HydrophobicContact CD2-CB 4.1Å
147	H	97.9	Very high	97.1	Very high	120 Å²	120	73.7 Å²	73.7	56%	0.556	36%	0.364	S	S	*	.	H	α-helix	trans	-59.9	-44.6	173.5	170.1	-94.1	0	0	0	111.3	A143 T144 L150 R151	A143-H147 WeakPolarHBondContact O-CB 3.17Å; A143-H147 PolarHBondContact O-N 3.34Å; T144-H147 PolarHBondContact O-N 3Å; H147-L150 PolarHBondContact O-N 3.22Å; H147-R151 WeakPolarHBondContact O-CG 3.29Å; H147-R151 PolarHBondContact O-N 2.8Å
148	Q	95.6	Very high	97	Very high	43 Å²	43	73.5 Å²	73.5	20%	0.201	37%	0.367	C	S	.	.	H	α-helix	trans	-61	-48.3	177	177.8	172.4	1.6	0	0	112.2	T144 W145 L146 L150 R151 E152 E305	T144-Q148 WeakPolarHBondContact O-CB 3.49Å; T144-Q148 PolarHBondContact O-N 3.38Å; W145-Q148 PolarHBondContact O-N 3.17Å; L146-Q148 VanDerWaalsContact C-N 3.33Å; L146-Q148 PolarHBondContact O-N 3.48Å; Q148-L150 VanDerWaalsContact C-N 3.25Å; Q148-L150 PolarHBondContact O-N 2.78Å; Q148-R151 CarbonylContact O-C 3.53Å; Q148-R151 WeakPolarHBondContact O-CA 3.27Å; Q148-R151 WeakPolarHBondContact O-CB 3.49Å; Q148-R151 PolarHBondContact O-N 2.85Å; Q148-E152 HydrophobicContact CG-CG 4.43Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.39Å; Q148-E152 PolarHBondContact NE2-OE1 3.06Å; Q148-E152 WeakPolarHBondContact O-CG 3.43Å; Q148-E152 PolarHBondContact O-N 3.22Å; Q148-E305 PolarHBondContact NE2-OE2 3.34Å
149	A	95.1	Very high	97	Very high	12 Å²	12	75.7 Å²	75.7	10%	0.099	38%	0.381	C	S	.	.	H	α-helix	trans	-57.8	-38.7	178.6	0	0	0	0	0	112.4	W145 L146 E152 G153 T154 V165	W145-A149 WeakPolarHBondContact O-CB 3.11Å; W145-A149 PolarHBondContact O-N 3.4Å; L146-A149 PolarHBondContact O-N 3.01Å; A149-E152 PolarHBondContact O-N 3.19Å; A149-G153 PolarHBondContact O-N 3.06Å; A149-T154 WeakPolarHBondContact O-CB 3.4Å; A149-T154 PolarHBondContact O-N 3.34Å; A149-T154 PolarHBondContact O-OG1 3.02Å; A149-T154 VanDerWaalsContact O-OG1 3.11Å; A149-V165 HydrophobicContact CB-CG2 4.05Å
150	L	96.6	Very high	96.9	Very high	106 Å²	106	81.2 Å²	81.2	56%	0.555	41%	0.406	S	S	*	.	H	α-helix	trans	-68.1	-39.2	174.8	-68.4	176.3	0	0	0	112.1	L146 H147 Q148 E152 G153 T154 V156	L146-L150 WeakPolarHBondContact O-CG 3.37Å; L146-L150 PolarHBondContact O-N 3.36Å; H147-L150 PolarHBondContact O-N 3.22Å; Q148-L150 VanDerWaalsContact C-N 3.25Å; Q148-L150 PolarHBondContact O-N 2.78Å; L150-E152 VanDerWaalsContact C-N 3.27Å; L150-E152 PolarHBondContact O-N 3.32Å; L150-G153 PolarHBondContact O-N 3.24Å; L150-G153 VanDerWaalsContact O-N 3.1Å; L150-T154 WeakPolarHBondContact CD2-O 3.22Å; L150-V156 HydrophobicContact CD2-CG2 4.37Å
151	R	96.6	Very high	96.8	Very high	199 Å²	199	84.7 Å²	84.7	75%	0.751	42%	0.423	S	S	*	.	H	α-helix	trans	-63.4	-34.2	174.7	-74.8	-75.2	-62.4	176.1	0.9	112.3	H147 Q148 G153	H147-R151 WeakPolarHBondContact O-CG 3.29Å; H147-R151 PolarHBondContact O-N 2.8Å; Q148-R151 CarbonylContact O-C 3.53Å; Q148-R151 WeakPolarHBondContact O-CA 3.27Å; Q148-R151 WeakPolarHBondContact O-CB 3.49Å; Q148-R151 PolarHBondContact O-N 2.85Å; R151-G153 PolarHBondContact O-N 2.77Å
152	E	96.3	Very high	96.8	Very high	119 Å²	119	84 Å²	84	56%	0.556	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-3.5	175.4	-69.5	167.1	-177.2	0	0	113.1	Q148 A149 L150	Q148-E152 HydrophobicContact CG-CG 4.43Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.39Å; Q148-E152 PolarHBondContact NE2-OE1 3.06Å; Q148-E152 WeakPolarHBondContact O-CG 3.43Å; Q148-E152 PolarHBondContact O-N 3.22Å; A149-E152 PolarHBondContact O-N 3.19Å; L150-E152 VanDerWaalsContact C-N 3.27Å; L150-E152 PolarHBondContact O-N 3.32Å
153	G	95.8	Very high	96.7	Very high	50 Å²	50	92 Å²	92	52%	0.515	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	11.6	172.1	0	0	0	0	0	114.9	A149 L150 R151 R155	A149-G153 PolarHBondContact O-N 3.06Å; L150-G153 PolarHBondContact O-N 3.24Å; L150-G153 VanDerWaalsContact O-N 3.1Å; R151-G153 PolarHBondContact O-N 2.77Å; G153-R155 PolarHBondContact O-N 3.34Å
154	T	95.9	Very high	96.5	Very high	63 Å²	63	96.6 Å²	96.6	39%	0.387	47%	0.469	S	S	.	.			trans	-60.2	126.8	172.7	-61.9	0	0	0	0	109.6	A149 L150 V156 V165	A149-T154 WeakPolarHBondContact O-CB 3.4Å; A149-T154 PolarHBondContact O-N 3.34Å; A149-T154 PolarHBondContact O-OG1 3.02Å; A149-T154 VanDerWaalsContact O-OG1 3.11Å; L150-T154 WeakPolarHBondContact CD2-O 3.22Å; T154-V156 HydrophobicContact CG2-CG2 4.06Å; T154-V165 HydrophobicContact CG2-CG2 4.32Å
155	R	95.8	Very high	96.5	Very high	203 Å²	203	95.1 Å²	95.1	77%	0.766	46%	0.46	S	S	*	.			trans	-101.5	123.6	177.9	-66.6	-173.5	178	-154.6	-0.4	109.8	G153	G153-R155 PolarHBondContact O-N 3.34Å
156	V	95.1	Very high	96.5	Very high	51 Å²	51	94.5 Å²	94.5	31%	0.309	46%	0.463	S	S	.	.			trans	-119	107.3	-177.5	-173.5	0	0	0	0	108.1	L150 T154 Q161 I162 V165	L150-V156 HydrophobicContact CD2-CG2 4.37Å; T154-V156 HydrophobicContact CG2-CG2 4.06Å; V156-Q161 HydrophobicContact CG1-CB 4.02Å; V156-I162 HydrophobicContact CG1-CB 4.19Å; V156-I162 HydrophobicContact CG1-CG1 3.37Å; V156-V165 HydrophobicContact CG1-CG1 4.3Å; V156-V165 HydrophobicContact CG2-CB 4.43Å; V156-V165 HydrophobicContact CG2-CG1 3.96Å
157	Q	96.3	Very high	96.5	Very high	167 Å²	167	95 Å²	95	78%	0.78	47%	0.47	S	S	*	.			trans	-118.6	-40.8	-176.7	-65.9	-169.8	-18.7	0	0	112.9
158	S	97.6	Very high	96.4	Very high	41 Å²	41	90.1 Å²	90.1	29%	0.287	45%	0.453	S	S	.	.	S	Bend	trans	-96.8	162.1	-178.4	92.5	0	0	0	0	112.5	E160 Q161 I162	S158-E160 VanDerWaalsContact CB-OE2 3.27Å; S158-E160 WeakPolarHBondContact CB-OE2 3.43Å; S158-E160 PolarHBondContact O-N 2.93Å; S158-E160 PolarHBondContact OG-N 3.12Å; S158-E160 PolarHBondContact OG-OE2 3.28Å; S158-Q161 PolarHBondContact O-N 2.86Å; S158-Q161 PolarHBondContact OG-N 3.08Å; S158-I162 WeakPolarHBondContact O-CG1 3.43Å; S158-I162 PolarHBondContact O-N 3.48Å
159	V	97.6	Very high	96.5	Very high	80 Å²	80	90 Å²	90	49%	0.485	46%	0.46	S	S	.	.	H	α-helix	trans	-62.9	-33.6	176.6	175.1	0	0	0	0	111.3	I162 R163	V159-I162 PolarHBondContact O-N 2.97Å; V159-R163 WeakPolarHBondContact O-CG 3.45Å; V159-R163 PolarHBondContact O-N 3.4Å
160	E	97.5	Very high	96.6	Very high	119 Å²	119	90.8 Å²	90.8	56%	0.556	47%	0.466	S	S	*	.	H	α-helix	trans	-63.6	-45.5	176.5	-61.5	66.7	-143.2	0	0	110.5	S158 I162 R163 E164	S158-E160 VanDerWaalsContact CB-OE2 3.27Å; S158-E160 WeakPolarHBondContact CB-OE2 3.43Å; S158-E160 PolarHBondContact O-N 2.93Å; S158-E160 PolarHBondContact OG-N 3.12Å; S158-E160 PolarHBondContact OG-OE2 3.28Å; E160-I162 VanDerWaalsContact C-N 3.33Å; E160-I162 PolarHBondContact O-N 3.36Å; E160-R163 PolarHBondContact O-N 2.92Å; E160-E164 WeakPolarHBondContact O-CB 3.3Å; E160-E164 PolarHBondContact O-N 3.31Å
161	Q	96.9	Very high	96.7	Very high	74 Å²	74	95.6 Å²	95.6	35%	0.346	48%	0.476	S	S	.	.	H	α-helix	trans	-64.5	-37	176.3	-67.1	172.8	-35.3	0	0	111.9	V156 S158 E164 V165	V156-Q161 HydrophobicContact CG1-CB 4.02Å; S158-Q161 PolarHBondContact O-N 2.86Å; S158-Q161 PolarHBondContact OG-N 3.08Å; Q161-E164 PolarHBondContact O-N 2.77Å; Q161-V165 WeakPolarHBondContact O-CB 3.38Å; Q161-V165 VanDerWaalsContact O-CG1 3.29Å; Q161-V165 WeakPolarHBondContact O-CG1 3.33Å; Q161-V165 PolarHBondContact O-N 3.06Å
162	I	97.4	Very high	96.8	Very high	91 Å²	91	87 Å²	87	47%	0.467	45%	0.445	S	S	.	.	H	α-helix	trans	-61.4	-45.3	174	-66.3	169.9	0	0	0	110.3	V156 S158 V159 E160 E164 A166	V156-I162 HydrophobicContact CG1-CB 4.19Å; V156-I162 HydrophobicContact CG1-CG1 3.37Å; S158-I162 WeakPolarHBondContact O-CG1 3.43Å; S158-I162 PolarHBondContact O-N 3.48Å; V159-I162 PolarHBondContact O-N 2.97Å; E160-I162 VanDerWaalsContact C-N 3.33Å; E160-I162 PolarHBondContact O-N 3.36Å; I162-E164 VanDerWaalsContact C-N 3.35Å; I162-A166 WeakPolarHBondContact O-CB 3.28Å; I162-A166 PolarHBondContact O-N 2.96Å
163	R	95.8	Very high	97	Very high	179 Å²	179	90 Å²	90	68%	0.675	45%	0.452	S	S	*	.	H	α-helix	trans	-66	-38.4	179	-71.7	176.9	-175.1	167.5	3.9	112.2	V159 E160 S167	V159-R163 WeakPolarHBondContact O-CG 3.45Å; V159-R163 PolarHBondContact O-N 3.4Å; E160-R163 PolarHBondContact O-N 2.92Å; R163-S167 WeakPolarHBondContact O-CA 3.43Å; R163-S167 PolarHBondContact O-N 3.44Å
164	E	95.9	Very high	97.1	Very high	149 Å²	149	90.5 Å²	90.5	70%	0.696	46%	0.456	S	S	*	.	H	α-helix	trans	-66.8	-53.2	179.1	-175.3	172.9	-168.3	0	0	111.4	E160 Q161 I162 A166 S167	E160-E164 WeakPolarHBondContact O-CB 3.3Å; E160-E164 PolarHBondContact O-N 3.31Å; Q161-E164 PolarHBondContact O-N 2.77Å; I162-E164 VanDerWaalsContact C-N 3.35Å; E164-A166 VanDerWaalsContact C-N 3.3Å; E164-A166 PolarHBondContact O-N 2.85Å; E164-S167 WeakPolarHBondContact O-CB 3.42Å; E164-S167 PolarHBondContact O-N 3.27Å; E164-S167 VanDerWaalsContact O-N 3.08Å
165	V	96.1	Very high	97.2	Very high	44 Å²	44	90 Å²	90	27%	0.267	45%	0.449	S	S	.	.	H	α-helix	trans	-67.7	-30.7	-178.2	76.5	0	0	0	0	112.6	L146 A149 T154 V156 Q161 S167	L146-V165 HydrophobicContact CD2-CB 4.34Å; L146-V165 HydrophobicContact CD2-CG1 3.77Å; L146-V165 HydrophobicContact CD2-CG2 4Å; L146-V165 WeakPolarHBondContact CD2-O 3.48Å; A149-V165 HydrophobicContact CB-CG2 4.05Å; T154-V165 HydrophobicContact CG2-CG2 4.32Å; V156-V165 HydrophobicContact CG1-CG1 4.3Å; V156-V165 HydrophobicContact CG2-CB 4.43Å; V156-V165 HydrophobicContact CG2-CG1 3.96Å; Q161-V165 WeakPolarHBondContact O-CB 3.38Å; Q161-V165 VanDerWaalsContact O-CG1 3.29Å; Q161-V165 WeakPolarHBondContact O-CG1 3.33Å; Q161-V165 PolarHBondContact O-N 3.06Å; V165-S167 VanDerWaalsContact C-N 3.35Å
166	A	96.9	Very high	97.4	Very high	25 Å²	25	81 Å²	81	21%	0.207	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	9.9	175.4	0	0	0	0	0	113.3	L146 I162 E164 G168 A169	L146-A166 HydrophobicContact CD1-CB 4.36Å; L146-A166 HydrophobicContact CD2-CB 4.1Å; I162-A166 WeakPolarHBondContact O-CB 3.28Å; I162-A166 PolarHBondContact O-N 2.96Å; E164-A166 VanDerWaalsContact C-N 3.3Å; E164-A166 PolarHBondContact O-N 2.85Å; A166-G168 PolarHBondContact O-N 3.22Å; A166-A169 VanDerWaalsContact O-CB 3.23Å; A166-A169 WeakPolarHBondContact O-CB 3.22Å; A166-A169 PolarHBondContact O-N 2.84Å
167	S	97.3	Very high	97.6	Very high	59 Å²	59	78.6 Å²	78.6	41%	0.413	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	136.2	-178	-175.5	0	0	0	0	111.1	R142 R163 E164 V165	R142-S167 WeakPolarHBondContact CD-O 3.27Å; R142-S167 PolarHBondContact NE-O 2.95Å; R142-S167 VanDerWaalsContact NE-O 3.12Å; R163-S167 WeakPolarHBondContact O-CA 3.43Å; R163-S167 PolarHBondContact O-N 3.44Å; E164-S167 WeakPolarHBondContact O-CB 3.42Å; E164-S167 PolarHBondContact O-N 3.27Å; E164-S167 VanDerWaalsContact O-N 3.08Å; V165-S167 VanDerWaalsContact C-N 3.35Å
168	G	95.7	Very high	97.7	Very high	19 Å²	19	70.6 Å²	70.6	20%	0.196	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	-5.8	-174.1	0	0	0	0	0	115.2	A166 A170	A166-G168 PolarHBondContact O-N 3.22Å; G168-A170 PolarHBondContact O-N 3.28Å
169	A	98.1	Very high	97.8	Very high	41 Å²	41	68.7 Å²	68.7	34%	0.339	35%	0.352	S	S	.	.			trans	-65.4	121.1	170	0	0	0	0	0	110.5	Y140 R142 A166	Y140-A169 CarbonylContact O-C 3.53Å; Y140-A169 VanDerWaalsContact O-CA 3.31Å; Y140-A169 WeakPolarHBondContact O-CA 3.5Å; R142-A169 HydrophobicContact CG-CB 4.17Å; A166-A169 VanDerWaalsContact O-CB 3.23Å; A166-A169 WeakPolarHBondContact O-CB 3.22Å; A166-A169 PolarHBondContact O-N 2.84Å
170	A	98.1	Very high	97.8	Very high	28 Å²	28	65 Å²	65	23%	0.231	33%	0.329	C	S	.	.			trans	-112.8	143.6	-172.6	0	0	0	0	0	114.7	Y140 R141 G168 I172	Y140-A170 HydrophobicContact CD1-CB 3.95Å; Y140-A170 HydrophobicContact CE1-CB 4.21Å; Y140-A170 PolarHBondContact O-N 3.02Å; R141-A170 PolarHBondContact NH2-O 2.87Å; G168-A170 PolarHBondContact O-N 3.28Å; A170-I172 PolarHBondContact O-N 3.4Å
171	R	98.8	Very high	97.9	Very high	206 Å²	206	59.6 Å²	59.6	78%	0.777	31%	0.305	S	S	*	.			trans	-61.9	131	172.7	171.9	177	-70.5	-165.1	-1	109.4	E175	R171-E175 VanDerWaalsContact O-CG 3.32Å; R171-E175 WeakPolarHBondContact O-CG 3.4Å
172	I	98.9	Very high	98	Very high	18 Å²	18	56 Å²	56	9%	0.092	29%	0.288	C	S	.	.			trans	-79.1	-42.2	-178.3	-67.8	163.6	0	0	0	112.9	L137 Y140 A170 G174 E175 F196 F198	L137-I172 HydrophobicContact CD2-CD1 3.45Å; L137-I172 VanDerWaalsContact CD2-CD1 3.45Å; Y140-I172 HydrophobicContact CD1-CG1 3.82Å; Y140-I172 HydrophobicContact CD2-CG1 4.5Å; Y140-I172 HydrophobicContact CG-CD1 4.5Å; Y140-I172 HydrophobicContact CG-CG1 3.81Å; A170-I172 PolarHBondContact O-N 3.4Å; I172-G174 PolarHBondContact O-N 3.23Å; I172-G174 VanDerWaalsContact O-N 3.14Å; I172-E175 VanDerWaalsContact O-CB 3.23Å; I172-E175 WeakPolarHBondContact O-CB 3.48Å; I172-E175 VanDerWaalsContact O-CG 3.28Å; I172-E175 WeakPolarHBondContact O-CG 3.22Å; I172-E175 PolarHBondContact O-N 3.18Å; I172-F196 HydrophobicContact CG2-CB 3.88Å; I172-F198 HydrophobicContact CB-CZ 4.47Å; I172-F198 HydrophobicContact CG1-CZ 4.41Å; I172-F198 HydrophobicContact CG2-CD1 4.21Å; I172-F198 HydrophobicContact CG2-CD2 3.59Å; I172-F198 HydrophobicContact CG2-CE1 3.95Å; I172-F198 HydrophobicContact CG2-CE2 3.29Å; I172-F198 HydrophobicContact CG2-CG 4.05Å; I172-F198 HydrophobicContact CG2-CZ 3.49Å; I172-F198 VanDerWaalsContact CG2-CZ 3.49Å
173	R	98.8	Very high	98	Very high	184 Å²	184	53.1 Å²	53.1	69%	0.694	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	122.4	-175.2	179.2	175.7	-66.5	-97.5	-4.5	110.8	G197	R173-G197 WeakPolarHBondContact CA-O 3.43Å
174	G	98.4	Very high	98.1	Very high	59 Å²	59	51.7 Å²	51.7	61%	0.608	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.7	-12.4	-178.7	0	0	0	0	0	114.5	I172 G197	I172-G174 PolarHBondContact O-N 3.23Å; I172-G174 VanDerWaalsContact O-N 3.14Å; G174-G197 PolarHBondContact N-O 3.18Å
175	E	98.8	Very high	98.2	Very high	53 Å²	53	46 Å²	46	25%	0.248	25%	0.25	C	S	.	.			trans	-69.6	153	172.5	-63.2	-81.6	115.5	0	0	110.6	Y140 R171 I172 F198 N199 D231	Y140-E175 HydrophobicContact CE1-CB 4.35Å; Y140-E175 HydrophobicContact CE1-CG 3.71Å; Y140-E175 VanDerWaalsContact CE1-OE2 3.25Å; Y140-E175 WeakPolarHBondContact CE1-OE2 3.38Å; Y140-E175 PolarHBondContact OH-OE2 2.68Å; R171-E175 VanDerWaalsContact O-CG 3.32Å; R171-E175 WeakPolarHBondContact O-CG 3.4Å; I172-E175 VanDerWaalsContact O-CB 3.23Å; I172-E175 WeakPolarHBondContact O-CB 3.48Å; I172-E175 VanDerWaalsContact O-CG 3.28Å; I172-E175 WeakPolarHBondContact O-CG 3.22Å; I172-E175 PolarHBondContact O-N 3.18Å; E175-F198 HydrophobicContact CB-CD1 3.82Å; E175-F198 HydrophobicContact CB-CE1 3.68Å; E175-F198 WeakPolarHBondContact O-CA 3.35Å; E175-F198 WeakPolarHBondContact O-CD1 3.46Å; E175-N199 PolarHBondContact O-N 2.99Å; E175-D231 HydrophobicContact CB-CB 4.41Å; E175-D231 VanDerWaalsContact OE2-CB 3.22Å; E175-D231 WeakPolarHBondContact OE2-CB 3.42Å
176	T	98.9	Very high	98.4	Very high	14 Å²	14	43.9 Å²	43.9	9%	0.086	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119.1	178	-58.2	0	0	0	0	111.3	N199 L201 H229 D231 C232	T176-N199 CarbonylContact C-O 3.56Å; T176-N199 VanDerWaalsContact CA-O 3.28Å; T176-N199 WeakPolarHBondContact CA-O 3.5Å; T176-N199 PolarHBondContact OG1-ND2 3.44Å; T176-L201 HydrophobicContact CG2-CB 4.4Å; T176-L201 HydrophobicContact CG2-CD1 3.39Å; T176-L201 HydrophobicContact CG2-CG 3.55Å; T176-H229 VanDerWaalsContact CB-O 3.27Å; T176-H229 WeakPolarHBondContact CB-O 3.36Å; T176-H229 VanDerWaalsContact CG2-O 3.24Å; T176-H229 WeakPolarHBondContact CG2-O 3.36Å; T176-D231 PolarHBondContact N-OD2 2.7Å; T176-D231 PolarHBondContact O-N 2.93Å; T176-C232 PolarHBondContact O-N 3.18Å; T176-C232 VanDerWaalsContact O-N 3.17Å
177	L	98.9	Very high	98.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	115.7	172.7	-178.8	67.3	0	0	0	109.5	I136 I179 V189 A193 F198 N199 V200 L201 C232 T234	I136-L177 HydrophobicContact CD1-CD1 3.86Å; I136-L177 HydrophobicContact CD1-CD2 4.11Å; L177-I179 HydrophobicContact CD2-CG1 4.47Å; L177-I179 HydrophobicContact CG-CG1 4.38Å; L177-V189 HydrophobicContact CD2-CG1 4.22Å; L177-A193 HydrophobicContact CD2-CB 3.51Å; L177-F198 HydrophobicContact CB-CB 4.23Å; L177-F198 HydrophobicContact CB-CD1 3.8Å; L177-F198 HydrophobicContact CB-CE1 4.3Å; L177-F198 HydrophobicContact CB-CG 4.03Å; L177-N199 PolarHBondContact N-O 3.17Å; L177-V200 WeakPolarHBondContact O-CA 3.38Å; L177-L201 PolarHBondContact O-N 3.23Å; L177-C232 CarbonylContact C-O 3.57Å; L177-C232 WeakPolarHBondContact CA-O 3.45Å; L177-C232 HydrophobicContact CD1-CB 3.88Å; L177-T234 HydrophobicContact CD1-CG2 3.92Å; L177-T234 HydrophobicContact CG-CG2 4.3Å
178	G	98.9	Very high	98.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	116.5	174.7	0	0	0	0	0	112	S230 C232 V233 T234	G178-S230 WeakPolarHBondContact CA-OG 3.14Å; G178-S230 PolarHBondContact N-OG 3.44Å; G178-C232 PolarHBondContact N-O 2.9Å; G178-V233 CarbonylContact O-C 3.53Å; G178-V233 WeakPolarHBondContact O-CA 3.34Å; G178-T234 PolarHBondContact O-N 3.5Å
179	I	98.9	Very high	98.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	120.9	177.9	-64.4	172.1	0	0	0	110.3	L177 G181 L182 V189 A190 V200 L201 F202 Y203 L226 T234	L177-I179 HydrophobicContact CD2-CG1 4.47Å; L177-I179 HydrophobicContact CG-CG1 4.38Å; I179-G181 VanDerWaalsContact CG2-O 3.26Å; I179-G181 WeakPolarHBondContact CG2-O 3.46Å; I179-L182 HydrophobicContact CG2-CD1 4.22Å; I179-V189 HydrophobicContact CD1-CG1 4.22Å; I179-A190 HydrophobicContact CD1-CB 3.69Å; I179-V200 HydrophobicContact CD1-CG1 3.63Å; I179-V200 HydrophobicContact CG1-CG1 4.36Å; I179-L201 PolarHBondContact N-O 3.22Å; I179-F202 HydrophobicContact CB-CB 4.04Å; I179-F202 HydrophobicContact CG2-CB 4.46Å; I179-F202 CarbonylContact O-C 3.6Å; I179-F202 WeakPolarHBondContact O-CA 3.26Å; I179-F202 WeakPolarHBondContact O-CB 3.29Å; I179-Y203 PolarHBondContact O-N 3.06Å; I179-L226 VanDerWaalsContact O-CD1 3.22Å; I179-L226 WeakPolarHBondContact O-CD1 3.36Å; I179-T234 HydrophobicContact CB-CG2 4.41Å; I179-T234 HydrophobicContact CG1-CG2 3.7Å
180	I	98.9	Very high	98.7	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	107.6	172.8	-62.4	173.1	0	0	0	108.7	Y203 L223 L226 L227 V233 T234 L235 H236 C237 L246 I247	I180-Y203 HydrophobicContact CG2-CD1 4.44Å; I180-L223 HydrophobicContact CD1-CD1 3.42Å; I180-L223 VanDerWaalsContact CD1-CD1 3.42Å; I180-L223 HydrophobicContact CG1-CD1 4.05Å; I180-L226 HydrophobicContact CD1-CD2 4.02Å; I180-L226 HydrophobicContact CG1-CD1 4.13Å; I180-L226 HydrophobicContact CG1-CD2 3.69Å; I180-L227 HydrophobicContact CD1-CD2 4.16Å; I180-V233 HydrophobicContact CD1-CG1 3.67Å; I180-V233 HydrophobicContact CG1-CG1 4.26Å; I180-T234 PolarHBondContact N-O 3.01Å; I180-L235 HydrophobicContact CB-CD2 3.88Å; I180-L235 HydrophobicContact CD1-CD2 3.56Å; I180-L235 HydrophobicContact CG1-CD2 4.19Å; I180-L235 HydrophobicContact CG2-CD2 4.3Å; I180-H236 CarbonylContact O-C 3.59Å; I180-H236 WeakPolarHBondContact O-CA 3.27Å; I180-H236 PolarHBondContact O-N 2.8Å; I180-C237 PolarHBondContact O-N 3.16Å; I180-C237 VanDerWaalsContact O-N 3.13Å; I180-L246 HydrophobicContact CG2-CD2 3.64Å; I180-I247 HydrophobicContact CD1-CD1 4.21Å
181	G	98.7	Very high	98.7	Very high	4 Å²	4	43.9 Å²	43.9	4%	0.041	21%	0.214	C	C	.	.			trans	92.2	110.2	-171.8	0	0	0	0	0	112.2	I179 Y203 D204 H236	I179-G181 VanDerWaalsContact CG2-O 3.26Å; I179-G181 WeakPolarHBondContact CG2-O 3.46Å; G181-Y203 PolarHBondContact N-O 2.86Å; G181-D204 WeakPolarHBondContact CA-OD2 3.5Å; G181-H236 WeakPolarHBondContact O-CB 3.5Å
182	L	98.6	Very high	98.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.188	C	C	.	.			trans	-106	46.4	-179	-163.1	79.2	0	0	0	111.4	I179 Q187 A190 F202 D204 L207 V211 L215 L217	I179-L182 HydrophobicContact CG2-CD1 4.22Å; L182-Q187 HydrophobicContact CD1-CG 4.28Å; L182-Q187 HydrophobicContact CD2-CG 4.38Å; L182-Q187 HydrophobicContact CG-CG 3.83Å; L182-Q187 PolarHBondContact O-NE2 3.46Å; L182-A190 HydrophobicContact CD1-CB 4.42Å; L182-F202 HydrophobicContact CB-CB 4.33Å; L182-F202 HydrophobicContact CB-CD2 3.51Å; L182-F202 HydrophobicContact CB-CE2 3.96Å; L182-F202 HydrophobicContact CB-CG 4Å; L182-F202 HydrophobicContact CD1-CB 4.03Å; L182-F202 HydrophobicContact CD1-CD1 4.46Å; L182-F202 HydrophobicContact CD1-CD2 4.44Å; L182-F202 HydrophobicContact CD1-CG 4.07Å; L182-F202 HydrophobicContact CD2-CD1 3.82Å; L182-F202 HydrophobicContact CD2-CD2 3.71Å; L182-F202 HydrophobicContact CD2-CE1 3.74Å; L182-F202 HydrophobicContact CD2-CE2 3.63Å; L182-F202 HydrophobicContact CD2-CG 3.79Å; L182-F202 HydrophobicContact CD2-CZ 3.63Å; L182-F202 HydrophobicContact CG-CD2 4.06Å; L182-F202 HydrophobicContact CG-CE2 4.38Å; L182-F202 HydrophobicContact CG-CG 4.15Å; L182-D204 HydrophobicContact CB-CB 4.36Å; L182-D204 PolarHBondContact N-OD2 3.12Å; L182-L207 HydrophobicContact CB-CD1 3.82Å; L182-L207 HydrophobicContact CD2-CD1 4.49Å; L182-V211 HydrophobicContact CD2-CG2 4.41Å; L182-L215 HydrophobicContact CD2-CD1 4.21Å; L182-L217 HydrophobicContact CD1-CD1 3.93Å; L182-L217 HydrophobicContact CD2-CD1 3.91Å
183	G	97.8	Very high	98.7	Very high	29 Å²	29	36.3 Å²	36.3	30%	0.299	18%	0.184	S	C	.	.	S	Bend	trans	-75.2	-158.5	169.8	0	0	0	0	0	112.6	V185 G186 Q187	G183-V185 PolarHBondContact O-N 2.68Å; G183-G186 PolarHBondContact O-N 3.38Å; G183-Q187 VanDerWaalsContact O-CG 3.26Å; G183-Q187 WeakPolarHBondContact O-CG 3.45Å; G183-Q187 PolarHBondContact O-N 2.7Å
184	R	98.4	Very high	98.7	Very high	150 Å²	150	31.4 Å²	31.4	57%	0.566	17%	0.168	S	C	*	.	H	α-helix	trans	-54.2	-53	-176.9	-62.9	179.3	-177	79.3	2.8	112.9	P121 V125 A188	P121-R184 WeakPolarHBondContact O-CD 3.49Å; V125-R184 HydrophobicContact CB-CB 4.47Å; V125-R184 HydrophobicContact CG1-CB 3.81Å; V125-R184 HydrophobicContact CG2-CB 3.75Å; V125-R184 HydrophobicContact CG2-CG 4.44Å; R184-A188 PolarHBondContact O-N 2.76Å; R184-A188 VanDerWaalsContact O-N 3.16Å
185	V	98.8	Very high	98.7	Very high	29 Å²	29	32.5 Å²	32.5	18%	0.176	17%	0.171	C	C	.	.	H	α-helix	trans	-68	-45.6	-179.9	178.4	0	0	0	0	111	V125 T128 A129 G183 Q187 A188 V189	V125-V185 HydrophobicContact CG1-CG2 4.45Å; T128-V185 HydrophobicContact CG2-CG1 3.82Å; T128-V185 HydrophobicContact CG2-CG2 4.24Å; A129-V185 HydrophobicContact CB-CG1 4.45Å; G183-V185 PolarHBondContact O-N 2.68Å; V185-Q187 VanDerWaalsContact C-N 3.28Å; V185-Q187 PolarHBondContact O-N 3.04Å; V185-A188 PolarHBondContact O-N 2.9Å; V185-A188 VanDerWaalsContact O-N 3.09Å; V185-V189 HydrophobicContact CG1-CG2 4.18Å; V185-V189 WeakPolarHBondContact O-CG2 3.38Å; V185-V189 PolarHBondContact O-N 2.95Å
186	G	98.8	Very high	98.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.2	-39.9	178.8	0	0	0	0	0	113.1	G183 A190	G183-G186 PolarHBondContact O-N 3.38Å; G186-A190 WeakPolarHBondContact O-CB 3.44Å; G186-A190 PolarHBondContact O-N 3.28Å
187	Q	98.8	Very high	98.7	Very high	67 Å²	67	34.3 Å²	34.3	31%	0.313	18%	0.182	S	C	.	.	H	α-helix	trans	-66.8	-45.3	174.1	-67.4	174.3	34.9	0	0	112.1	L182 G183 V185 V189 A190 L191 L215	L182-Q187 HydrophobicContact CD1-CG 4.28Å; L182-Q187 HydrophobicContact CD2-CG 4.38Å; L182-Q187 HydrophobicContact CG-CG 3.83Å; L182-Q187 PolarHBondContact O-NE2 3.46Å; G183-Q187 VanDerWaalsContact O-CG 3.26Å; G183-Q187 WeakPolarHBondContact O-CG 3.45Å; G183-Q187 PolarHBondContact O-N 2.7Å; V185-Q187 VanDerWaalsContact C-N 3.28Å; V185-Q187 PolarHBondContact O-N 3.04Å; Q187-V189 VanDerWaalsContact C-N 3.3Å; Q187-V189 PolarHBondContact O-N 3.47Å; Q187-A190 PolarHBondContact O-N 3.12Å; Q187-L191 WeakPolarHBondContact O-CG 3.47Å; Q187-L191 PolarHBondContact O-N 2.92Å; Q187-L215 HydrophobicContact CB-CD1 4.35Å; Q187-L215 HydrophobicContact CG-CD1 3.73Å
188	A	98.9	Very high	98.7	Very high	6 Å²	6	34.9 Å²	34.9	5%	0.05	18%	0.184	C	C	.	.	H	α-helix	trans	-61.1	-38.4	178.1	0	0	0	0	0	112.4	V125 A129 R184 V185 R192	V125-A188 HydrophobicContact CG1-CB 4.24Å; A129-A188 HydrophobicContact CB-CB 3.59Å; R184-A188 PolarHBondContact O-N 2.76Å; R184-A188 VanDerWaalsContact O-N 3.16Å; V185-A188 PolarHBondContact O-N 2.9Å; V185-A188 VanDerWaalsContact O-N 3.09Å; A188-R192 WeakPolarHBondContact O-CD 3.46Å; A188-R192 WeakPolarHBondContact O-CG 3.36Å; A188-R192 PolarHBondContact O-N 3.49Å; A188-R192 PolarHBondContact O-NH1 3.28Å
189	V	98.9	Very high	98.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.3	-46.3	173.5	168.1	0	0	0	0	111.2	A129 T132 L133 L177 I179 V185 Q187 L191 R192 A193 T234	A129-V189 HydrophobicContact CB-CG2 3.7Å; T132-V189 HydrophobicContact CG2-CG1 4.26Å; T132-V189 HydrophobicContact CG2-CG2 3.95Å; L133-V189 HydrophobicContact CD2-CB 4.07Å; L133-V189 HydrophobicContact CD2-CG1 3.79Å; L133-V189 HydrophobicContact CD2-CG2 3.95Å; L177-V189 HydrophobicContact CD2-CG1 4.22Å; I179-V189 HydrophobicContact CD1-CG1 4.22Å; V185-V189 HydrophobicContact CG1-CG2 4.18Å; V185-V189 WeakPolarHBondContact O-CG2 3.38Å; V185-V189 PolarHBondContact O-N 2.95Å; Q187-V189 VanDerWaalsContact C-N 3.3Å; Q187-V189 PolarHBondContact O-N 3.47Å; V189-L191 VanDerWaalsContact C-N 3.33Å; V189-L191 PolarHBondContact O-N 3.23Å; V189-R192 PolarHBondContact O-N 2.95Å; V189-A193 VanDerWaalsContact O-CB 3.32Å; V189-A193 WeakPolarHBondContact O-CB 3.35Å; V189-A193 PolarHBondContact O-N 3.01Å; V189-T234 HydrophobicContact CG1-CG2 4.49Å
190	A	98.9	Very high	98.7	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	20%	0.204	C	C	.	.	H	α-helix	trans	-56.9	-45	179.3	0	0	0	0	0	112.4	I179 L182 G186 Q187 A193 K194 V200 L217	I179-A190 HydrophobicContact CD1-CB 3.69Å; L182-A190 HydrophobicContact CD1-CB 4.42Å; G186-A190 WeakPolarHBondContact O-CB 3.44Å; G186-A190 PolarHBondContact O-N 3.28Å; Q187-A190 PolarHBondContact O-N 3.12Å; A190-A193 PolarHBondContact O-N 3.09Å; A190-K194 WeakPolarHBondContact O-CG 3.43Å; A190-K194 PolarHBondContact O-N 3.5Å; A190-V200 HydrophobicContact CB-CG1 3.93Å; A190-L217 HydrophobicContact CB-CD1 3.82Å; A190-L217 HydrophobicContact CB-CD2 4Å
191	L	98.7	Very high	98.7	Very high	97 Å²	97	38.4 Å²	38.4	51%	0.508	20%	0.204	S	C	.	.	H	α-helix	trans	-64	-41.4	179.6	-68.6	175.7	0	0	0	112.1	Q187 V189	Q187-L191 WeakPolarHBondContact O-CG 3.47Å; Q187-L191 PolarHBondContact O-N 2.92Å; V189-L191 VanDerWaalsContact C-N 3.33Å; V189-L191 PolarHBondContact O-N 3.23Å
192	R	98.9	Very high	98.7	Very high	65 Å²	65	38.2 Å²	38.2	25%	0.245	20%	0.202	C	C	.	.	H	α-helix	trans	-67.9	-45.8	176.2	-71.8	167.1	169.5	74.6	-6.4	112.1	E126 D130 L133 A188 V189 K194 A195 F196	E126-R192 IonicContact OE2-CZ 3.93Å; E126-R192 IonicContact OE2-NH1 3.26Å; E126-R192 PolarHBondContact OE2-NH1 2.8Å; E126-R192 IonicContact OE2-NH2 3.97Å; E126-R192 PolarHBondContact OE2-NH2 2.82Å; D130-R192 IonicContact OD1-CZ 3.69Å; D130-R192 IonicContact OD1-NE 3.69Å; D130-R192 PolarHBondContact OD1-NE 2.86Å; D130-R192 IonicContact OD1-NH2 3.52Å; D130-R192 PolarHBondContact OD1-NH2 3.46Å; D130-R192 IonicContact OD2-NH2 3.17Å; L133-R192 HydrophobicContact CD1-CB 4.42Å; L133-R192 HydrophobicContact CD2-CB 3.84Å; L133-R192 HydrophobicContact CG-CB 3.88Å; A188-R192 WeakPolarHBondContact O-CD 3.46Å; A188-R192 WeakPolarHBondContact O-CG 3.36Å; A188-R192 PolarHBondContact O-N 3.49Å; A188-R192 PolarHBondContact O-NH1 3.28Å; V189-R192 PolarHBondContact O-N 2.95Å; R192-K194 PolarHBondContact O-N 3.33Å; R192-A195 WeakPolarHBondContact O-CB 3.45Å; R192-A195 PolarHBondContact O-N 2.95Å; R192-F196 WeakPolarHBondContact O-CD2 3.28Å
193	A	98.8	Very high	98.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.7	-35.5	-177.2	0	0	0	0	0	112.5	L177 V189 A190 A195 F196 F198 V200	L177-A193 HydrophobicContact CD2-CB 3.51Å; V189-A193 VanDerWaalsContact O-CB 3.32Å; V189-A193 WeakPolarHBondContact O-CB 3.35Å; V189-A193 PolarHBondContact O-N 3.01Å; A190-A193 PolarHBondContact O-N 3.09Å; A193-A195 VanDerWaalsContact C-N 3.27Å; A193-A195 PolarHBondContact O-N 3.4Å; A193-F196 PolarHBondContact O-N 2.84Å; A193-F196 VanDerWaalsContact O-N 3.09Å; A193-F198 HydrophobicContact CB-CB 4.27Å; A193-F198 HydrophobicContact CB-CD2 3.99Å; A193-F198 HydrophobicContact CB-CG 4.47Å; A193-F198 PolarHBondContact O-N 3.31Å; A193-V200 HydrophobicContact CB-CG2 4.05Å
194	K	98.5	Very high	98.8	Very high	81 Å²	81	40 Å²	40	35%	0.352	20%	0.201	S	C	.	.	H	α-helix	trans	-55.8	-38.1	174.7	-78.2	-179.5	169	-169.4	0	113.6	A190 R192 F196 G197 V200 L215 G216 L217	A190-K194 WeakPolarHBondContact O-CG 3.43Å; A190-K194 PolarHBondContact O-N 3.5Å; R192-K194 PolarHBondContact O-N 3.33Å; K194-F196 PolarHBondContact O-N 3.39Å; K194-G197 PolarHBondContact O-N 3.1Å; K194-V200 HydrophobicContact CG-CG2 4.23Å; K194-L215 PolarHBondContact NZ-O 2.87Å; K194-G216 WeakPolarHBondContact CE-O 3.12Å; K194-G216 PolarHBondContact NZ-O 3.34Å; K194-L217 VanDerWaalsContact CE-CD2 3.4Å
195	A	98.7	Very high	98.7	Very high	82 Å²	82	36.1 Å²	36.1	68%	0.678	20%	0.195	S	C	*	.	H	α-helix	trans	-64.5	-27.7	-179.7	0	0	0	0	0	112.5	R192 A193 G197	R192-A195 WeakPolarHBondContact O-CB 3.45Å; R192-A195 PolarHBondContact O-N 2.95Å; A193-A195 VanDerWaalsContact C-N 3.27Å; A193-A195 PolarHBondContact O-N 3.4Å; A195-G197 VanDerWaalsContact C-N 3.29Å
196	F	98.8	Very high	98.6	Very high	88 Å²	88	42.3 Å²	42.3	39%	0.386	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-7.2	175.1	-66.2	-91.2	0	0	0	113.2	L133 L137 I172 R192 A193 K194 F198	L133-F196 HydrophobicContact CD1-CD2 4.48Å; L133-F196 HydrophobicContact CD1-CE2 4.45Å; L137-F196 HydrophobicContact CD1-CE1 3.84Å; L137-F196 HydrophobicContact CD1-CZ 3.79Å; L137-F196 HydrophobicContact CD2-CD1 3.86Å; L137-F196 HydrophobicContact CD2-CE1 3.79Å; L137-F196 HydrophobicContact CD2-CG 4.49Å; L137-F196 HydrophobicContact CD2-CZ 4.38Å; L137-F196 HydrophobicContact CG-CE1 4.45Å; I172-F196 HydrophobicContact CG2-CB 3.88Å; R192-F196 WeakPolarHBondContact O-CD2 3.28Å; A193-F196 PolarHBondContact O-N 2.84Å; A193-F196 VanDerWaalsContact O-N 3.09Å; K194-F196 PolarHBondContact O-N 3.39Å; F196-F198 HydrophobicContact CB-CD2 4.22Å
197	G	98.7	Very high	98.5	Very high	17 Å²	17	44.7 Å²	44.7	18%	0.175	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	22.9	179.8	0	0	0	0	0	114.6	R173 G174 K194 A195	R173-G197 WeakPolarHBondContact CA-O 3.43Å; G174-G197 PolarHBondContact N-O 3.18Å; K194-G197 PolarHBondContact O-N 3.1Å; A195-G197 VanDerWaalsContact C-N 3.29Å
198	F	98.9	Very high	98.4	Very high	12 Å²	12	46 Å²	46	5%	0.053	25%	0.245	C	C	.	.			trans	-67.8	143	167.6	-81.1	-73.4	0	0	0	111.1	I136 Y140 I172 E175 L177 A193 F196 V200	I136-F198 HydrophobicContact CG2-CE2 3.96Å; I136-F198 HydrophobicContact CG2-CZ 3.77Å; Y140-F198 HydrophobicContact CD2-CZ 4.07Å; Y140-F198 AromaticContact CE2-CE1 3.9Å; Y140-F198 HydrophobicContact CE2-CE1 3.9Å; Y140-F198 AromaticContact CE2-CZ 3.65Å; Y140-F198 HydrophobicContact CE2-CZ 3.65Å; Y140-F198 AromaticContact CZ-CE1 3.88Å; I172-F198 HydrophobicContact CB-CZ 4.47Å; I172-F198 HydrophobicContact CG1-CZ 4.41Å; I172-F198 HydrophobicContact CG2-CD1 4.21Å; I172-F198 HydrophobicContact CG2-CD2 3.59Å; I172-F198 HydrophobicContact CG2-CE1 3.95Å; I172-F198 HydrophobicContact CG2-CE2 3.29Å; I172-F198 HydrophobicContact CG2-CG 4.05Å; I172-F198 HydrophobicContact CG2-CZ 3.49Å; I172-F198 VanDerWaalsContact CG2-CZ 3.49Å; E175-F198 HydrophobicContact CB-CD1 3.82Å; E175-F198 HydrophobicContact CB-CE1 3.68Å; E175-F198 WeakPolarHBondContact O-CA 3.35Å; E175-F198 WeakPolarHBondContact O-CD1 3.46Å; L177-F198 HydrophobicContact CB-CB 4.23Å; L177-F198 HydrophobicContact CB-CD1 3.8Å; L177-F198 HydrophobicContact CB-CE1 4.3Å; L177-F198 HydrophobicContact CB-CG 4.03Å; A193-F198 HydrophobicContact CB-CB 4.27Å; A193-F198 HydrophobicContact CB-CD2 3.99Å; A193-F198 HydrophobicContact CB-CG 4.47Å; A193-F198 PolarHBondContact O-N 3.31Å; F196-F198 HydrophobicContact CB-CD2 4.22Å; F198-V200 HydrophobicContact CB-CG2 4.24Å
199	N	98.8	Very high	98.2	Very high	71 Å²	71	52 Å²	52	38%	0.38	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	122	155.6	179.1	35	0	0	0	108.4	E175 T176 L177	E175-N199 PolarHBondContact O-N 2.99Å; T176-N199 CarbonylContact C-O 3.56Å; T176-N199 VanDerWaalsContact CA-O 3.28Å; T176-N199 WeakPolarHBondContact CA-O 3.5Å; T176-N199 PolarHBondContact OG1-ND2 3.44Å; L177-N199 PolarHBondContact N-O 3.17Å
200	V	98.9	Very high	98	Very high	6 Å²	6	53.2 Å²	53.2	4%	0.036	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.2	-174.5	-176	0	0	0	0	110.5	L177 I179 A190 A193 K194 F198 L217 Q218	L177-V200 WeakPolarHBondContact O-CA 3.38Å; I179-V200 HydrophobicContact CD1-CG1 3.63Å; I179-V200 HydrophobicContact CG1-CG1 4.36Å; A190-V200 HydrophobicContact CB-CG1 3.93Å; A193-V200 HydrophobicContact CB-CG2 4.05Å; K194-V200 HydrophobicContact CG-CG2 4.23Å; F198-V200 HydrophobicContact CB-CG2 4.24Å; V200-L217 HydrophobicContact CB-CD2 3.78Å; V200-L217 HydrophobicContact CG1-CD2 3.82Å; V200-Q218 PolarHBondContact O-N 3.01Å
201	L	98.6	Very high	97.9	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	151.3	170.2	-61.7	-179.8	0	0	0	109.8	T176 L177 I179 Q218 H229	T176-L201 HydrophobicContact CG2-CB 4.4Å; T176-L201 HydrophobicContact CG2-CD1 3.39Å; T176-L201 HydrophobicContact CG2-CG 3.55Å; L177-L201 PolarHBondContact O-N 3.23Å; I179-L201 PolarHBondContact N-O 3.22Å; L201-Q218 CarbonylContact C-O 3.56Å; L201-Q218 VanDerWaalsContact CA-O 3.29Å; L201-Q218 WeakPolarHBondContact CA-O 3.38Å; L201-Q218 HydrophobicContact CD2-CB 3.66Å; L201-Q218 HydrophobicContact CD2-CG 3.47Å; L201-Q218 VanDerWaalsContact CD2-CG 3.47Å; L201-H229 HydrophobicContact CD1-CB 3.52Å
202	F	98.9	Very high	97.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	152.5	167.1	79.1	-83.2	0	0	0	113.7	I179 L182 D204 L207 V211 E212 L217 Q218 R219 V220	I179-F202 HydrophobicContact CB-CB 4.04Å; I179-F202 HydrophobicContact CG2-CB 4.46Å; I179-F202 CarbonylContact O-C 3.6Å; I179-F202 WeakPolarHBondContact O-CA 3.26Å; I179-F202 WeakPolarHBondContact O-CB 3.29Å; L182-F202 HydrophobicContact CB-CB 4.33Å; L182-F202 HydrophobicContact CB-CD2 3.51Å; L182-F202 HydrophobicContact CB-CE2 3.96Å; L182-F202 HydrophobicContact CB-CG 4Å; L182-F202 HydrophobicContact CD1-CB 4.03Å; L182-F202 HydrophobicContact CD1-CD1 4.46Å; L182-F202 HydrophobicContact CD1-CD2 4.44Å; L182-F202 HydrophobicContact CD1-CG 4.07Å; L182-F202 HydrophobicContact CD2-CD1 3.82Å; L182-F202 HydrophobicContact CD2-CD2 3.71Å; L182-F202 HydrophobicContact CD2-CE1 3.74Å; L182-F202 HydrophobicContact CD2-CE2 3.63Å; L182-F202 HydrophobicContact CD2-CG 3.79Å; L182-F202 HydrophobicContact CD2-CZ 3.63Å; L182-F202 HydrophobicContact CG-CD2 4.06Å; L182-F202 HydrophobicContact CG-CE2 4.38Å; L182-F202 HydrophobicContact CG-CG 4.15Å; F202-D204 HydrophobicContact CD2-CB 4.14Å; F202-D204 HydrophobicContact CE2-CB 4.3Å; F202-L207 HydrophobicContact CE2-CD1 4.49Å; F202-V211 HydrophobicContact CE2-CG2 4.38Å; F202-V211 HydrophobicContact CZ-CG2 3.93Å; F202-E212 HydrophobicContact CE1-CB 3.59Å; F202-E212 HydrophobicContact CZ-CB 3.83Å; F202-L217 HydrophobicContact CD1-CB 4.05Å; F202-L217 HydrophobicContact CD1-CD1 4.36Å; F202-L217 HydrophobicContact CE1-CB 4.08Å; F202-Q218 PolarHBondContact N-O 3.25Å; F202-R219 HydrophobicContact CD1-CB 4.28Å; F202-R219 HydrophobicContact CD2-CG 4.3Å; F202-R219 HydrophobicContact CE1-CB 3.56Å; F202-R219 HydrophobicContact CE1-CG 4.01Å; F202-R219 HydrophobicContact CE2-CB 4.16Å; F202-R219 HydrophobicContact CE2-CG 3.63Å; F202-R219 HydrophobicContact CZ-CB 3.5Å; F202-R219 HydrophobicContact CZ-CG 3.47Å; F202-R219 VanDerWaalsContact CZ-CG 3.47Å; F202-R219 WeakPolarHBondContact O-CA 3.43Å; F202-V220 PolarHBondContact O-N 2.96Å
203	Y	98.9	Very high	97.7	Very high	47 Å²	47	57.5 Å²	57.5	18%	0.184	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	120.3	170.5	169.8	-109.4	0	0	0	108	I179 I180 G181 P205 S221 L223	I179-Y203 PolarHBondContact O-N 3.06Å; I180-Y203 HydrophobicContact CG2-CD1 4.44Å; G181-Y203 PolarHBondContact N-O 2.86Å; Y203-P205 HydrophobicContact CE1-CG 4.26Å; Y203-P205 HydrophobicContact CE2-CB 4.24Å; Y203-P205 HydrophobicContact CE2-CG 4.47Å; Y203-S221 WeakPolarHBondContact CE2-O 3.26Å; Y203-L223 HydrophobicContact CD1-CB 4.19Å; Y203-L223 HydrophobicContact CD1-CD1 4.21Å; Y203-L223 HydrophobicContact CE1-CB 3.95Å
204	D	98.6	Very high	97.6	Very high	18 Å²	18	61.7 Å²	61.7	10%	0.096	34%	0.337	C	S	.	.			trans	-147.6	106.5	171.5	-166.3	-39.7	0	0	0	107.9	G181 L182 F202 Y206 L207 R219	G181-D204 WeakPolarHBondContact CA-OD2 3.5Å; L182-D204 HydrophobicContact CB-CB 4.36Å; L182-D204 PolarHBondContact N-OD2 3.12Å; F202-D204 HydrophobicContact CD2-CB 4.14Å; F202-D204 HydrophobicContact CE2-CB 4.3Å; D204-Y206 PolarHBondContact O-N 3.29Å; D204-Y206 PolarHBondContact OD1-N 3.27Å; D204-L207 HydrophobicContact CB-CD1 3.87Å; D204-L207 HydrophobicContact CB-CG 4.06Å; D204-R219 PolarHBondContact O-NH2 2.95Å
205	P	97.6	Very high	97.5	Very high	70 Å²	70	59.8 Å²	59.8	46%	0.455	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-8.9	-175	31	-34.8	0	0	0	113.2	Y203	Y203-P205 HydrophobicContact CE1-CG 4.26Å; Y203-P205 HydrophobicContact CE2-CB 4.24Å; Y203-P205 HydrophobicContact CE2-CG 4.47Å
206	Y	97.1	Very high	97.5	Very high	159 Å²	159	58.3 Å²	58.3	62%	0.624	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-13.2	-173.3	-55.9	-67.2	0	0	0	113.7	D204	D204-Y206 PolarHBondContact O-N 3.29Å; D204-Y206 PolarHBondContact OD1-N 3.27Å
207	L	96.1	Very high	97.4	Very high	50 Å²	50	55 Å²	55	26%	0.262	31%	0.31	S	S	.	.	S	Bend	trans	-79.1	142.5	177.6	-66.2	179.3	0	0	0	112.1	L182 F202 D204 V211 R219	L182-L207 HydrophobicContact CB-CD1 3.82Å; L182-L207 HydrophobicContact CD2-CD1 4.49Å; F202-L207 HydrophobicContact CE2-CD1 4.49Å; D204-L207 HydrophobicContact CB-CD1 3.87Å; D204-L207 HydrophobicContact CB-CG 4.06Å; L207-V211 HydrophobicContact CB-CG2 4.37Å; L207-V211 HydrophobicContact CD1-CG2 4.05Å; L207-R219 PolarHBondContact O-NH1 3.2Å; L207-R219 PolarHBondContact O-NH2 2.77Å
208	S	95.4	Very high	97.4	Very high	93 Å²	93	59.2 Å²	59.2	65%	0.65	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-66.5	158.1	166.9	52.4	0	0	0	0	111.5	R219	S208-R219 PolarHBondContact O-NH1 3.41Å
209	D	95.5	Very high	97.4	Very high	134 Å²	134	61.4 Å²	61.4	72%	0.717	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	147.6	175.8	-64.6	-25.3	0	0	0	112	R219	D209-R219 IonicContact OD1-NH1 3.36Å; D209-R219 PolarHBondContact OD1-NH1 2.88Å
210	G	95.4	Very high	97.4	Very high	24 Å²	24	58.8 Å²	58.8	25%	0.247	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	112.9	-21	171.3	0	0	0	0	0	115	E212 R213 A214	G210-E212 VanDerWaalsContact CA-OE1 3.29Å; G210-E212 WeakPolarHBondContact CA-OE1 3.31Å; G210-E212 PolarHBondContact N-OE1 2.92Å; G210-E212 PolarHBondContact N-OE2 2.88Å; G210-E212 PolarHBondContact O-N 3.32Å; G210-R213 PolarHBondContact O-N 3.46Å; G210-R213 VanDerWaalsContact O-N 3.12Å; G210-A214 PolarHBondContact O-N 3.02Å; G210-A214 VanDerWaalsContact O-N 3.08Å
211	V	96.1	Very high	97.4	Very high	35 Å²	35	63.7 Å²	63.7	21%	0.212	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-35.6	177.2	-64.4	0	0	0	0	111.9	L182 F202 L207 R213 A214 L215	L182-V211 HydrophobicContact CD2-CG2 4.41Å; F202-V211 HydrophobicContact CE2-CG2 4.38Å; F202-V211 HydrophobicContact CZ-CG2 3.93Å; L207-V211 HydrophobicContact CB-CG2 4.37Å; L207-V211 HydrophobicContact CD1-CG2 4.05Å; V211-R213 VanDerWaalsContact C-N 3.32Å; V211-R213 PolarHBondContact O-N 2.95Å; V211-A214 PolarHBondContact O-N 2.76Å; V211-L215 PolarHBondContact O-N 2.87Å; V211-L215 VanDerWaalsContact O-N 3.08Å
212	E	96.4	Very high	97.4	Very high	27 Å²	27	66.4 Å²	66.4	13%	0.126	37%	0.371	C	S	.	.	H	α-helix	trans	-62.9	-38.5	176.2	70	-67.7	154.6	0	0	112.1	F202 G210 G216 L217 R219	F202-E212 HydrophobicContact CE1-CB 3.59Å; F202-E212 HydrophobicContact CZ-CB 3.83Å; G210-E212 VanDerWaalsContact CA-OE1 3.29Å; G210-E212 WeakPolarHBondContact CA-OE1 3.31Å; G210-E212 PolarHBondContact N-OE1 2.92Å; G210-E212 PolarHBondContact N-OE2 2.88Å; G210-E212 PolarHBondContact O-N 3.32Å; E212-G216 CarbonylContact O-C 3.55Å; E212-G216 WeakPolarHBondContact O-CA 3.17Å; E212-G216 PolarHBondContact O-N 3.06Å; E212-L217 PolarHBondContact O-N 2.61Å; E212-R219 HydrophobicContact CB-CB 3.95Å; E212-R219 HydrophobicContact CG-CB 4.14Å
213	R	96.7	Very high	97.4	Very high	192 Å²	192	67.5 Å²	67.5	73%	0.725	38%	0.377	S	S	*	.	H	α-helix	trans	-72.4	-43.2	178	-73.3	-178	-91.5	-179.8	-4.5	111.6	G210 V211 L215 G216	G210-R213 PolarHBondContact O-N 3.46Å; G210-R213 VanDerWaalsContact O-N 3.12Å; V211-R213 VanDerWaalsContact C-N 3.32Å; V211-R213 PolarHBondContact O-N 2.95Å; R213-L215 VanDerWaalsContact C-N 3.3Å; R213-L215 PolarHBondContact O-N 3.26Å; R213-G216 PolarHBondContact O-N 3.26Å
214	A	97.3	Very high	97.3	Very high	87 Å²	87	70.6 Å²	70.6	72%	0.719	39%	0.393	S	S	*	.	H	α-helix	trans	-61.8	-39	179	0	0	0	0	0	112.3	G210 V211	G210-A214 PolarHBondContact O-N 3.02Å; G210-A214 VanDerWaalsContact O-N 3.08Å; V211-A214 PolarHBondContact O-N 2.76Å
215	L	96.8	Very high	97.4	Very high	42 Å²	42	72.7 Å²	72.7	22%	0.22	40%	0.404	C	S	.	.	H	α-helix	trans	-93.5	-5.2	-178.9	-62.2	174.7	0	0	0	113.3	L182 Q187 K194 V211 R213 L217	L182-L215 HydrophobicContact CD2-CD1 4.21Å; Q187-L215 HydrophobicContact CB-CD1 4.35Å; Q187-L215 HydrophobicContact CG-CD1 3.73Å; K194-L215 PolarHBondContact NZ-O 2.87Å; V211-L215 PolarHBondContact O-N 2.87Å; V211-L215 VanDerWaalsContact O-N 3.08Å; R213-L215 VanDerWaalsContact C-N 3.3Å; R213-L215 PolarHBondContact O-N 3.26Å; L215-L217 HydrophobicContact CB-CD1 3.78Å; L215-L217 HydrophobicContact CB-CG 3.79Å; L215-L217 HydrophobicContact CD1-CD1 4.02Å
216	G	97.5	Very high	97.4	Very high	51 Å²	51	69.3 Å²	69.3	53%	0.526	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	43.5	-175.2	0	0	0	0	0	112.7	K194 E212 R213	K194-G216 WeakPolarHBondContact CE-O 3.12Å; K194-G216 PolarHBondContact NZ-O 3.34Å; E212-G216 CarbonylContact O-C 3.55Å; E212-G216 WeakPolarHBondContact O-CA 3.17Å; E212-G216 PolarHBondContact O-N 3.06Å; R213-G216 PolarHBondContact O-N 3.26Å
217	L	98.2	Very high	97.5	Very high	18 Å²	18	61.8 Å²	61.8	9%	0.094	35%	0.353	C	S	.	.			trans	-109.2	162.7	178.6	-57.4	175.4	0	0	0	109.6	L182 A190 K194 V200 F202 E212 L215	L182-L217 HydrophobicContact CD1-CD1 3.93Å; L182-L217 HydrophobicContact CD2-CD1 3.91Å; A190-L217 HydrophobicContact CB-CD1 3.82Å; A190-L217 HydrophobicContact CB-CD2 4Å; K194-L217 VanDerWaalsContact CE-CD2 3.4Å; V200-L217 HydrophobicContact CB-CD2 3.78Å; V200-L217 HydrophobicContact CG1-CD2 3.82Å; F202-L217 HydrophobicContact CD1-CB 4.05Å; F202-L217 HydrophobicContact CD1-CD1 4.36Å; F202-L217 HydrophobicContact CE1-CB 4.08Å; E212-L217 PolarHBondContact O-N 2.61Å; L215-L217 HydrophobicContact CB-CD1 3.78Å; L215-L217 HydrophobicContact CB-CG 3.79Å; L215-L217 HydrophobicContact CD1-CD1 4.02Å
218	Q	98.4	Very high	97.6	Very high	106 Å²	106	65.3 Å²	65.3	50%	0.495	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.7	171.4	172.3	-178.1	-18.7	0	0	109.8	V200 L201 F202	V200-Q218 PolarHBondContact O-N 3.01Å; L201-Q218 CarbonylContact C-O 3.56Å; L201-Q218 VanDerWaalsContact CA-O 3.29Å; L201-Q218 WeakPolarHBondContact CA-O 3.38Å; L201-Q218 HydrophobicContact CD2-CB 3.66Å; L201-Q218 HydrophobicContact CD2-CG 3.47Å; L201-Q218 VanDerWaalsContact CD2-CG 3.47Å; F202-Q218 PolarHBondContact N-O 3.25Å
219	R	98.7	Very high	97.8	Very high	58 Å²	58	64.5 Å²	64.5	22%	0.219	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	142.2	174.1	-169.8	173.5	-175	177.4	-1.2	110.1	F202 D204 L207 S208 D209 E212	F202-R219 HydrophobicContact CD1-CB 4.28Å; F202-R219 HydrophobicContact CD2-CG 4.3Å; F202-R219 HydrophobicContact CE1-CB 3.56Å; F202-R219 HydrophobicContact CE1-CG 4.01Å; F202-R219 HydrophobicContact CE2-CB 4.16Å; F202-R219 HydrophobicContact CE2-CG 3.63Å; F202-R219 HydrophobicContact CZ-CB 3.5Å; F202-R219 HydrophobicContact CZ-CG 3.47Å; F202-R219 VanDerWaalsContact CZ-CG 3.47Å; F202-R219 WeakPolarHBondContact O-CA 3.43Å; D204-R219 PolarHBondContact O-NH2 2.95Å; L207-R219 PolarHBondContact O-NH1 3.2Å; L207-R219 PolarHBondContact O-NH2 2.77Å; S208-R219 PolarHBondContact O-NH1 3.41Å; D209-R219 IonicContact OD1-NH1 3.36Å; D209-R219 PolarHBondContact OD1-NH1 2.88Å; E212-R219 HydrophobicContact CB-CB 3.95Å; E212-R219 HydrophobicContact CG-CB 4.14Å
220	V	98.6	Very high	97.9	Very high	15 Å²	15	58.1 Å²	58.1	9%	0.091	32%	0.318	C	S	.	.			trans	-116.9	151.6	167.2	-60.5	0	0	0	0	110.5	F202 D225 L226	F202-V220 PolarHBondContact O-N 2.96Å; V220-D225 HydrophobicContact CB-CB 3.91Å; V220-D225 HydrophobicContact CG1-CB 4.3Å; V220-D225 HydrophobicContact CG2-CB 4.24Å; V220-L226 HydrophobicContact CG2-CB 3.69Å; V220-L226 HydrophobicContact CG2-CD1 4.36Å; V220-L226 HydrophobicContact CG2-CG 4.49Å
221	S	97.8	Very high	98.1	Very high	110 Å²	110	58.3 Å²	58.3	77%	0.769	31%	0.313	S	S	*	.	S	Bend	trans	-87.7	-18.8	-170.9	-55.1	0	0	0	0	113.7	Y203	Y203-S221 WeakPolarHBondContact CE2-O 3.26Å
222	T	98.6	Very high	98.2	Very high	58 Å²	58	56.7 Å²	56.7	36%	0.356	30%	0.303	S	S	.	.	S	Bend	trans	-129.7	153.3	-179.1	75.7	0	0	0	0	111.4	Q224 D225 L226	T222-Q224 VanDerWaalsContact C-N 3.27Å; T222-Q224 PolarHBondContact O-N 3.24Å; T222-D225 PolarHBondContact O-N 2.92Å; T222-D225 PolarHBondContact OG1-N 2.81Å; T222-D225 VanDerWaalsContact OG1-N 3.08Å; T222-D225 PolarHBondContact OG1-OD2 3.25Å; T222-L226 PolarHBondContact O-N 2.86Å
223	L	98.8	Very high	98.3	Very high	23 Å²	23	55.4 Å²	55.4	12%	0.12	30%	0.297	C	S	.	.	H	α-helix	trans	-58.5	-42.6	171.5	176.8	63.5	0	0	0	111.1	I180 Y203 D225 L226 L227 L246 T251	I180-L223 HydrophobicContact CD1-CD1 3.42Å; I180-L223 VanDerWaalsContact CD1-CD1 3.42Å; I180-L223 HydrophobicContact CG1-CD1 4.05Å; Y203-L223 HydrophobicContact CD1-CB 4.19Å; Y203-L223 HydrophobicContact CD1-CD1 4.21Å; Y203-L223 HydrophobicContact CE1-CB 3.95Å; L223-D225 VanDerWaalsContact C-N 3.33Å; L223-D225 PolarHBondContact O-N 3.08Å; L223-L226 WeakPolarHBondContact O-CB 3.47Å; L223-L226 PolarHBondContact O-N 3.3Å; L223-L226 VanDerWaalsContact O-N 3.1Å; L223-L227 HydrophobicContact CD1-CD1 4.11Å; L223-L227 HydrophobicContact CD1-CD2 4.25Å; L223-L227 HydrophobicContact CD1-CG 4.02Å; L223-L227 HydrophobicContact CD2-CD1 4.3Å; L223-L227 HydrophobicContact CG-CD1 3.82Å; L223-L227 HydrophobicContact CG-CG 4.14Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.19Å; L223-L246 HydrophobicContact CD2-CD1 3.67Å; L223-L246 HydrophobicContact CD2-CG 4.02Å; L223-T251 HydrophobicContact CD2-CG2 4.01Å
224	Q	98.7	Very high	98.5	Very high	113 Å²	113	46.2 Å²	46.2	53%	0.528	26%	0.263	S	S	.	.	H	α-helix	trans	-57.8	-44.9	-179.9	179.7	-179.6	-14	0	0	111.9	T222 L226 L227 F228	T222-Q224 VanDerWaalsContact C-N 3.27Å; T222-Q224 PolarHBondContact O-N 3.24Å; Q224-L226 VanDerWaalsContact C-N 3.26Å; Q224-L226 PolarHBondContact O-N 2.83Å; Q224-L227 PolarHBondContact O-N 3.47Å; Q224-F228 VanDerWaalsContact O-CB 3.27Å; Q224-F228 WeakPolarHBondContact O-CB 3.31Å; Q224-F228 PolarHBondContact O-N 2.89Å
225	D	98.7	Very high	98.5	Very high	61 Å²	61	42.1 Å²	42.1	33%	0.326	23%	0.228	S	C	.	.	H	α-helix	trans	-60.7	-38.9	177.7	-67.2	-42.8	0	0	0	111.4	V220 T222 L223 H229	V220-D225 HydrophobicContact CB-CB 3.91Å; V220-D225 HydrophobicContact CG1-CB 4.3Å; V220-D225 HydrophobicContact CG2-CB 4.24Å; T222-D225 PolarHBondContact O-N 2.92Å; T222-D225 PolarHBondContact OG1-N 2.81Å; T222-D225 VanDerWaalsContact OG1-N 3.08Å; T222-D225 PolarHBondContact OG1-OD2 3.25Å; L223-D225 VanDerWaalsContact C-N 3.33Å; L223-D225 PolarHBondContact O-N 3.08Å; D225-H229 PolarHBondContact O-N 3.03Å; D225-H229 PolarHBondContact O-ND1 3.06Å
226	L	98.9	Very high	98.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-52.1	176.2	-172.7	141.2	0	0	0	110.9	I179 I180 V220 T222 L223 Q224 F228 H229 S230 V233	I179-L226 VanDerWaalsContact O-CD1 3.22Å; I179-L226 WeakPolarHBondContact O-CD1 3.36Å; I180-L226 HydrophobicContact CD1-CD2 4.02Å; I180-L226 HydrophobicContact CG1-CD1 4.13Å; I180-L226 HydrophobicContact CG1-CD2 3.69Å; V220-L226 HydrophobicContact CG2-CB 3.69Å; V220-L226 HydrophobicContact CG2-CD1 4.36Å; V220-L226 HydrophobicContact CG2-CG 4.49Å; T222-L226 PolarHBondContact O-N 2.86Å; L223-L226 WeakPolarHBondContact O-CB 3.47Å; L223-L226 PolarHBondContact O-N 3.3Å; L223-L226 VanDerWaalsContact O-N 3.1Å; Q224-L226 VanDerWaalsContact C-N 3.26Å; Q224-L226 PolarHBondContact O-N 2.83Å; L226-F228 VanDerWaalsContact C-N 3.28Å; L226-F228 PolarHBondContact O-N 3.03Å; L226-H229 PolarHBondContact O-N 3.19Å; L226-S230 VanDerWaalsContact O-CB 3.29Å; L226-S230 WeakPolarHBondContact O-CB 3.35Å; L226-S230 PolarHBondContact O-N 3.3Å; L226-S230 VanDerWaalsContact O-N 3.16Å; L226-S230 PolarHBondContact O-OG 3.03Å; L226-V233 HydrophobicContact CD2-CG1 4.17Å; L226-V233 HydrophobicContact CD2-CG2 4.17Å
227	L	98.8	Very high	98.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-38.6	-176.5	-62.2	177.8	0	0	0	111.6	I180 L223 Q224 H229 V233 I247 T251 Q254 M255	I180-L227 HydrophobicContact CD1-CD2 4.16Å; L223-L227 HydrophobicContact CD1-CD1 4.11Å; L223-L227 HydrophobicContact CD1-CD2 4.25Å; L223-L227 HydrophobicContact CD1-CG 4.02Å; L223-L227 HydrophobicContact CD2-CD1 4.3Å; L223-L227 HydrophobicContact CG-CD1 3.82Å; L223-L227 HydrophobicContact CG-CG 4.14Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.19Å; Q224-L227 PolarHBondContact O-N 3.47Å; L227-H229 PolarHBondContact O-N 3.33Å; L227-V233 HydrophobicContact CD2-CG1 4.07Å; L227-V233 HydrophobicContact CD2-CG2 3.92Å; L227-I247 HydrophobicContact CD2-CD1 4.17Å; L227-T251 HydrophobicContact CD1-CG2 4.47Å; L227-T251 WeakPolarHBondContact CD1-O 3.44Å; L227-Q254 CarbonylContact C-O 3.44Å; L227-Q254 HydrophobicContact CB-CB 4.24Å; L227-Q254 HydrophobicContact CD1-CB 4.24Å; L227-M255 HydrophobicContact CB-CG 4.13Å; L227-M255 HydrophobicContact CD2-CG 3.93Å; L227-M255 HydrophobicContact CG-CG 4.4Å
228	F	98.6	Very high	98.7	Very high	125 Å²	125	41.5 Å²	41.5	55%	0.548	23%	0.226	S	C	.	.	H	α-helix	trans	-69.2	-32.7	-179.4	-175.9	-100	0	0	0	113.4	Q224 L226 Q254 R256	Q224-F228 VanDerWaalsContact O-CB 3.27Å; Q224-F228 WeakPolarHBondContact O-CB 3.31Å; Q224-F228 PolarHBondContact O-N 2.89Å; L226-F228 VanDerWaalsContact C-N 3.28Å; L226-F228 PolarHBondContact O-N 3.03Å; F228-Q254 WeakPolarHBondContact CA-O 3.31Å; F228-Q254 PolarHBondContact N-O 3.29Å; F228-R256 WeakPolarHBondContact O-CG 3.39Å; F228-R256 PolarHBondContact O-NE 3.23Å
229	H	98.7	Very high	98.7	Very high	75 Å²	75	38.5 Å²	38.5	35%	0.347	21%	0.213	S	C	.	.	H	α-helix	trans	-97.4	-5.4	-175.8	-65.4	97.9	0	0	0	114.5	T176 L201 D225 L226 L227 R256	T176-H229 VanDerWaalsContact CB-O 3.27Å; T176-H229 WeakPolarHBondContact CB-O 3.36Å; T176-H229 VanDerWaalsContact CG2-O 3.24Å; T176-H229 WeakPolarHBondContact CG2-O 3.36Å; L201-H229 HydrophobicContact CD1-CB 3.52Å; D225-H229 PolarHBondContact O-N 3.03Å; D225-H229 PolarHBondContact O-ND1 3.06Å; L226-H229 PolarHBondContact O-N 3.19Å; L227-H229 PolarHBondContact O-N 3.33Å; H229-R256 VanDerWaalsContact O-CZ 3.27Å; H229-R256 PolarHBondContact O-NH2 2.81Å
230	S	98.9	Very high	98.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.218	C	C	.	.			trans	-101.4	132.1	-172.6	-55.8	0	0	0	0	112.7	G178 L226	G178-S230 WeakPolarHBondContact CA-OG 3.14Å; G178-S230 PolarHBondContact N-OG 3.44Å; L226-S230 VanDerWaalsContact O-CB 3.29Å; L226-S230 WeakPolarHBondContact O-CB 3.35Å; L226-S230 PolarHBondContact O-N 3.3Å; L226-S230 VanDerWaalsContact O-N 3.16Å; L226-S230 PolarHBondContact O-OG 3.03Å
231	D	98.9	Very high	98.4	Very high	29 Å²	29	45.8 Å²	45.8	16%	0.155	25%	0.251	C	S	.	.	S	Bend	trans	-84.5	-27.5	172	-55.1	-56.9	0	0	0	111.1	E175 T176 R256 A259 F260	E175-D231 HydrophobicContact CB-CB 4.41Å; E175-D231 VanDerWaalsContact OE2-CB 3.22Å; E175-D231 WeakPolarHBondContact OE2-CB 3.42Å; T176-D231 PolarHBondContact N-OD2 2.7Å; T176-D231 PolarHBondContact O-N 2.93Å; D231-R256 WeakPolarHBondContact OD1-CD 3.37Å; D231-R256 IonicContact OD1-CZ 3.71Å; D231-R256 IonicContact OD1-NE 3.97Å; D231-R256 IonicContact OD1-NH1 2.71Å; D231-R256 PolarHBondContact OD1-NH1 3.05Å; D231-R256 IonicContact OD2-NH1 3.33Å; D231-R256 PolarHBondContact OD2-NH1 2.72Å; D231-A259 CarbonylContact O-C 3.52Å; D231-A259 WeakPolarHBondContact O-CA 3.46Å; D231-A259 WeakPolarHBondContact O-CB 3.49Å; D231-F260 PolarHBondContact O-N 2.99Å
232	C	98.9	Very high	98.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	129.4	169.8	-178.4	0	0	0	0	109.4	Y140 T176 L177 G178 F260	Y140-C232 HydrophobicContact CE2-CB 3.93Å; T176-C232 PolarHBondContact O-N 3.18Å; T176-C232 VanDerWaalsContact O-N 3.17Å; L177-C232 CarbonylContact C-O 3.57Å; L177-C232 WeakPolarHBondContact CA-O 3.45Å; L177-C232 HydrophobicContact CD1-CB 3.88Å; G178-C232 PolarHBondContact N-O 2.9Å; C232-F260 WeakPolarHBondContact CA-O 3.5Å; C232-F260 HydrophobicContact CB-CB 4.06Å
233	V	98.9	Very high	98.3	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.2	174.7	176.6	0	0	0	0	108.9	G178 I180 L226 L227 L235 M255 F260 L261 V262	G178-V233 CarbonylContact O-C 3.53Å; G178-V233 WeakPolarHBondContact O-CA 3.34Å; I180-V233 HydrophobicContact CD1-CG1 3.67Å; I180-V233 HydrophobicContact CG1-CG1 4.26Å; L226-V233 HydrophobicContact CD2-CG1 4.17Å; L226-V233 HydrophobicContact CD2-CG2 4.17Å; L227-V233 HydrophobicContact CD2-CG1 4.07Å; L227-V233 HydrophobicContact CD2-CG2 3.92Å; V233-L235 HydrophobicContact CG1-CD2 4.41Å; V233-M255 HydrophobicContact CB-CE 4.07Å; V233-M255 HydrophobicContact CG2-CE 3.87Å; V233-F260 PolarHBondContact N-O 3.24Å; V233-L261 HydrophobicContact CB-CD1 4.12Å; V233-L261 HydrophobicContact CG1-CD1 4.07Å; V233-L261 CarbonylContact O-C 3.45Å; V233-L261 WeakPolarHBondContact O-CA 3.19Å; V233-V262 PolarHBondContact O-N 2.9Å
234	T	98.9	Very high	98.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.9	176	-174.8	0	0	0	0	111.9	T132 L177 G178 I179 I180 V189 H236 V262	T132-T234 WeakPolarHBondContact CG2-OG1 3.25Å; L177-T234 HydrophobicContact CD1-CG2 3.92Å; L177-T234 HydrophobicContact CG-CG2 4.3Å; G178-T234 PolarHBondContact O-N 3.5Å; I179-T234 HydrophobicContact CB-CG2 4.41Å; I179-T234 HydrophobicContact CG1-CG2 3.7Å; I180-T234 PolarHBondContact N-O 3.01Å; V189-T234 HydrophobicContact CG1-CG2 4.49Å; T234-H236 PolarHBondContact OG1-CE1 3.17Å; T234-H236 PolarHBondContact OG1-NE2 3.3Å; T234-V262 VanDerWaalsContact CA-O 3.31Å; T234-V262 WeakPolarHBondContact CA-O 3.36Å
235	L	98.9	Very high	98.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.5	-175.7	-55.1	-175.9	0	0	0	111.2	I180 V233 I247 V262 N263 A265 L269 V270	I180-L235 HydrophobicContact CB-CD2 3.88Å; I180-L235 HydrophobicContact CD1-CD2 3.56Å; I180-L235 HydrophobicContact CG1-CD2 4.19Å; I180-L235 HydrophobicContact CG2-CD2 4.3Å; V233-L235 HydrophobicContact CG1-CD2 4.41Å; L235-I247 HydrophobicContact CD1-CG1 4.11Å; L235-I247 HydrophobicContact CD2-CD1 4.41Å; L235-I247 HydrophobicContact CD2-CG1 4.16Å; L235-V262 PolarHBondContact N-O 3.37Å; L235-N263 HydrophobicContact CD1-CB 4.16Å; L235-A265 HydrophobicContact CB-CB 4.23Å; L235-A265 VanDerWaalsContact O-CB 3.32Å; L235-A265 WeakPolarHBondContact O-CB 3.29Å; L235-L269 HydrophobicContact CB-CD1 4.38Å; L235-L269 HydrophobicContact CD1-CB 3.91Å; L235-L269 HydrophobicContact CD1-CD1 4.33Å; L235-V270 HydrophobicContact CD1-CG2 3.5Å; L235-V270 VanDerWaalsContact CD1-CG2 3.5Å
236	H	98.8	Very high	98.3	Very high	22 Å²	22	44.4 Å²	44.4	10%	0.102	23%	0.226	C	C	.	.			trans	-138.6	17.8	178.6	-63.6	-44.9	0	0	0	113.2	T132 I180 G181 T234	T132-H236 VanDerWaalsContact CG2-CE1 3.47Å; T132-H236 WeakPolarHBondContact CG2-CE1 3.32Å; T132-H236 PolarHBondContact OG1-CE1 3.33Å; I180-H236 CarbonylContact O-C 3.59Å; I180-H236 WeakPolarHBondContact O-CA 3.27Å; I180-H236 PolarHBondContact O-N 2.8Å; G181-H236 WeakPolarHBondContact O-CB 3.5Å; T234-H236 PolarHBondContact OG1-CE1 3.17Å; T234-H236 PolarHBondContact OG1-NE2 3.3Å
237	C	98.6	Very high	98.3	Very high	25 Å²	25	44.4 Å²	44.4	17%	0.169	23%	0.226	C	C	.	.	S	Bend	trans	-89.8	149.9	172.4	60.9	0	0	0	0	111.2	I180	I180-C237 PolarHBondContact O-N 3.16Å; I180-C237 VanDerWaalsContact O-N 3.13Å
238	G	97.9	Very high	98.3	Very high	51 Å²	51	46.6 Å²	46.6	53%	0.526	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-72.4	145.6	170.3	0	0	0	0	0	111.1	N240 N243	G238-N240 PolarHBondContact O-ND2 3.03Å; G238-N243 PolarHBondContact O-ND2 3.11Å
239	L	98.3	Very high	98.3	Very high	43 Å²	43	44.3 Å²	44.3	23%	0.225	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-69.3	133.3	171.4	-177.4	63.7	0	0	0	109.8	D103 H244 R266 L269	D103-L239 HydrophobicContact CB-CB 4.08Å; L239-H244 HydrophobicContact CD1-CB 4.39Å; L239-R266 HydrophobicContact CB-CB 3.85Å; L239-R266 HydrophobicContact CB-CG 3.84Å; L239-R266 HydrophobicContact CD2-CB 4.44Å; L239-L269 HydrophobicContact CB-CD2 4.44Å; L239-L269 HydrophobicContact CD1-CD2 3.86Å; L239-L269 HydrophobicContact CD1-CG 4.31Å
240	N	96.2	Very high	98.3	Very high	57 Å²	57	47.4 Å²	47.4	31%	0.305	24%	0.244	S	C	.	.			trans	-149.8	176.6	177.5	60.6	73.9	0	0	0	110	G238 H242 N243	G238-N240 PolarHBondContact O-ND2 3.03Å; N240-H242 PolarHBondContact O-N 3.1Å; N240-H242 WeakPolarHBondContact OD1-CB 3.26Å; N240-H242 PolarHBondContact OD1-N 3.38Å; N240-N243 PolarHBondContact N-OD1 3.3Å; N240-N243 PolarHBondContact ND2-ND2 3.15Å; N240-N243 PolarHBondContact ND2-OD1 2.94Å; N240-N243 PolarHBondContact O-N 2.88Å; N240-N243 PolarHBondContact O-OD1 3.42Å
241	E	95.1	Very high	98.3	Very high	169 Å²	169	48 Å²	48	79%	0.79	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.1	-175.9	67.6	-168.8	167.9	0	0	114.8
242	H	97.5	Very high	98.3	Very high	138 Å²	138	46.8 Å²	46.8	64%	0.639	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-7.9	-175.4	-51.8	115.6	0	0	0	114.5	N240	N240-H242 PolarHBondContact O-N 3.1Å; N240-H242 WeakPolarHBondContact OD1-CB 3.26Å; N240-H242 PolarHBondContact OD1-N 3.38Å
243	N	98.4	Very high	98.2	Very high	14 Å²	14	53.7 Å²	53.7	8%	0.075	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.2	16.5	-173.2	71	-2	0	0	0	114.5	G238 N240 H245 L246 L269	G238-N243 PolarHBondContact O-ND2 3.11Å; N240-N243 PolarHBondContact N-OD1 3.3Å; N240-N243 PolarHBondContact ND2-ND2 3.15Å; N240-N243 PolarHBondContact ND2-OD1 2.94Å; N240-N243 PolarHBondContact O-N 2.88Å; N240-N243 PolarHBondContact O-OD1 3.42Å; N243-H245 PolarHBondContact O-N 2.71Å; N243-L246 HydrophobicContact CB-CB 4.34Å; N243-L246 HydrophobicContact CB-CD1 4.2Å; N243-L246 WeakPolarHBondContact O-CB 3.43Å; N243-L246 PolarHBondContact O-N 2.8Å; N243-L246 VanDerWaalsContact O-N 3.12Å; N243-L269 HydrophobicContact CB-CD2 4.35Å; N243-L269 WeakPolarHBondContact O-CD2 3.35Å
244	H	98.4	Very high	98.2	Very high	117 Å²	117	55.3 Å²	55.3	54%	0.542	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	129.5	165.3	-176.6	-85.7	0	0	0	110.1	L239 L246 G268	L239-H244 HydrophobicContact CD1-CB 4.39Å; H244-L246 VanDerWaalsContact C-N 3.26Å; H244-L246 PolarHBondContact O-N 2.94Å; H244-G268 WeakPolarHBondContact CA-O 3.32Å
245	H	98.7	Very high	98.2	Very high	37 Å²	37	56.1 Å²	56.1	17%	0.171	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	51	44.7	-172.1	-68.5	-158	0	0	0	112.1	N243 I247 N248 G268 L269 D271 E293	N243-H245 PolarHBondContact O-N 2.71Å; H245-I247 PolarHBondContact O-N 3.32Å; H245-N248 HydrophobicContact CB-CB 4.36Å; H245-N248 WeakPolarHBondContact O-CB 3.49Å; H245-N248 PolarHBondContact O-ND2 3.3Å; H245-G268 PolarHBondContact N-O 3.39Å; H245-L269 CarbonylContact C-O 3.54Å; H245-D271 HydrophobicContact CB-CB 4.29Å; H245-D271 IonicContact CE1-OD2 2.77Å; H245-D271 WeakPolarHBondContact ND1-CB 3.27Å; H245-D271 IonicContact ND1-OD2 3.97Å; H245-D271 PolarHBondContact ND1-OD2 2.82Å; H245-E293 IonicContact CE1-OE1 3.02Å; H245-E293 IonicContact NE2-OE1 3.99Å; H245-E293 IonicContact NE2-OE2 3.71Å
246	L	98.8	Very high	98.1	Very high	30 Å²	30	60.3 Å²	60.3	16%	0.157	30%	0.299	C	S	.	.	S	Bend	trans	-52.2	-42.2	172.7	-173.5	67.8	0	0	0	111.6	I180 L223 N243 H244 T251 L269	I180-L246 HydrophobicContact CG2-CD2 3.64Å; L223-L246 HydrophobicContact CD2-CD1 3.67Å; L223-L246 HydrophobicContact CD2-CG 4.02Å; N243-L246 HydrophobicContact CB-CB 4.34Å; N243-L246 HydrophobicContact CB-CD1 4.2Å; N243-L246 WeakPolarHBondContact O-CB 3.43Å; N243-L246 PolarHBondContact O-N 2.8Å; N243-L246 VanDerWaalsContact O-N 3.12Å; H244-L246 VanDerWaalsContact C-N 3.26Å; H244-L246 PolarHBondContact O-N 2.94Å; L246-T251 WeakPolarHBondContact O-CG2 3.29Å; L246-T251 PolarHBondContact O-OG1 2.65Å; L246-L269 PolarHBondContact N-O 2.87Å
247	I	98.8	Very high	98.1	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-95.8	107.9	170	-53.9	-56.3	0	0	0	107.9	I180 L227 L235 H245 T251 V252 L261 L269 V270 D271	I180-I247 HydrophobicContact CD1-CD1 4.21Å; L227-I247 HydrophobicContact CD2-CD1 4.17Å; L235-I247 HydrophobicContact CD1-CG1 4.11Å; L235-I247 HydrophobicContact CD2-CD1 4.41Å; L235-I247 HydrophobicContact CD2-CG1 4.16Å; H245-I247 PolarHBondContact O-N 3.32Å; I247-T251 VanDerWaalsContact CA-OG1 3.3Å; I247-T251 WeakPolarHBondContact CA-OG1 3.38Å; I247-V252 HydrophobicContact CG2-CG2 3.47Å; I247-V252 VanDerWaalsContact CG2-CG2 3.47Å; I247-L261 HydrophobicContact CG2-CD2 4.14Å; I247-L269 PolarHBondContact N-O 2.85Å; I247-V270 HydrophobicContact CB-CB 4.44Å; I247-V270 HydrophobicContact CB-CG1 4.29Å; I247-V270 HydrophobicContact CB-CG2 4.12Å; I247-V270 HydrophobicContact CG1-CG2 4.31Å; I247-V270 HydrophobicContact CG2-CG1 4.28Å; I247-V270 WeakPolarHBondContact O-CA 3.45Å; I247-D271 PolarHBondContact O-N 3.34Å
248	N	98.6	Very high	98	Very high	45 Å²	45	65.3 Å²	65.3	24%	0.241	32%	0.323	C	S	.	.	S	Bend	trans	-140.4	-177.6	-175.4	60.2	50	0	0	0	111	H245 F250 T251 V252 D271	H245-N248 HydrophobicContact CB-CB 4.36Å; H245-N248 WeakPolarHBondContact O-CB 3.49Å; H245-N248 PolarHBondContact O-ND2 3.3Å; N248-F250 PolarHBondContact O-N 2.96Å; N248-F250 WeakPolarHBondContact OD1-CA 3.19Å; N248-F250 WeakPolarHBondContact OD1-CB 3.4Å; N248-F250 PolarHBondContact OD1-N 3.41Å; N248-T251 PolarHBondContact N-OG1 2.82Å; N248-T251 PolarHBondContact O-N 2.95Å; N248-T251 PolarHBondContact O-OG1 2.88Å; N248-T251 PolarHBondContact OD1-N 3.41Å; N248-T251 PolarHBondContact OD1-OG1 3.42Å; N248-V252 WeakPolarHBondContact O-CB 3.48Å; N248-V252 WeakPolarHBondContact O-CG2 3.19Å; N248-V252 PolarHBondContact O-N 2.84Å; N248-D271 HydrophobicContact CB-CB 4.25Å
249	D	97.9	Very high	98	Very high	78 Å²	78	63 Å²	63	42%	0.417	30%	0.299	S	S	.	.	H	α-helix	trans	-53.5	-30.8	-178.9	-91.2	-47	0	0	0	114.3	K253 A274	D249-K253 VanDerWaalsContact O-CD 3.26Å; D249-K253 WeakPolarHBondContact O-CD 3.49Å; D249-K253 VanDerWaalsContact O-CE 3.24Å; D249-K253 WeakPolarHBondContact O-CE 3.36Å; D249-K253 VanDerWaalsContact O-CG 3.31Å; D249-K253 WeakPolarHBondContact O-CG 3.31Å; D249-A274 HydrophobicContact CB-CB 4.25Å; D249-A274 VanDerWaalsContact N-CB 3.35Å
250	F	98.6	Very high	98.1	Very high	140 Å²	140	61.1 Å²	61.1	61%	0.614	29%	0.289	S	S	*	.	H	α-helix	trans	-80.6	-49.4	177.8	177.2	-103.4	0	0	0	111.9	N248 K253 Q254	N248-F250 PolarHBondContact O-N 2.96Å; N248-F250 WeakPolarHBondContact OD1-CA 3.19Å; N248-F250 WeakPolarHBondContact OD1-CB 3.4Å; N248-F250 PolarHBondContact OD1-N 3.41Å; F250-K253 WeakPolarHBondContact O-CB 3.29Å; F250-K253 PolarHBondContact O-N 3.39Å; F250-Q254 VanDerWaalsContact CZ-NE2 3.35Å
251	T	98.6	Very high	98.2	Very high	11 Å²	11	58.4 Å²	58.4	7%	0.067	28%	0.275	C	S	.	.	H	α-helix	trans	-73.7	-30.9	-176	52.1	0	0	0	0	112.3	L223 L227 L246 I247 N248 K253 Q254 M255	L223-T251 HydrophobicContact CD2-CG2 4.01Å; L227-T251 HydrophobicContact CD1-CG2 4.47Å; L227-T251 WeakPolarHBondContact CD1-O 3.44Å; L246-T251 WeakPolarHBondContact O-CG2 3.29Å; L246-T251 PolarHBondContact O-OG1 2.65Å; I247-T251 VanDerWaalsContact CA-OG1 3.3Å; I247-T251 WeakPolarHBondContact CA-OG1 3.38Å; N248-T251 PolarHBondContact N-OG1 2.82Å; N248-T251 PolarHBondContact O-N 2.95Å; N248-T251 PolarHBondContact O-OG1 2.88Å; N248-T251 PolarHBondContact OD1-N 3.41Å; N248-T251 PolarHBondContact OD1-OG1 3.42Å; T251-K253 PolarHBondContact O-N 2.96Å; T251-Q254 WeakPolarHBondContact O-CB 3.35Å; T251-Q254 PolarHBondContact O-N 2.88Å; T251-M255 PolarHBondContact O-N 2.74Å
252	V	98.4	Very high	98.4	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.024	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-32.8	172.9	179.6	0	0	0	0	111.6	I247 N248 Q254 M255 A278 I284	I247-V252 HydrophobicContact CG2-CG2 3.47Å; I247-V252 VanDerWaalsContact CG2-CG2 3.47Å; N248-V252 WeakPolarHBondContact O-CB 3.48Å; N248-V252 WeakPolarHBondContact O-CG2 3.19Å; N248-V252 PolarHBondContact O-N 2.84Å; V252-Q254 PolarHBondContact O-N 3.13Å; V252-M255 HydrophobicContact CG1-SD 4.4Å; V252-M255 WeakPolarHBondContact O-CB 3.36Å; V252-M255 PolarHBondContact O-N 3.08Å; V252-A278 HydrophobicContact CG1-CB 3.59Å; V252-I284 HydrophobicContact CG1-CD1 3.72Å; V252-I284 HydrophobicContact CG1-CG1 4.15Å
253	K	98	Very high	98.4	Very high	145 Å²	145	43.8 Å²	43.8	63%	0.63	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-15	175.3	-67.8	169.3	-172.7	169.9	0	113.5	D249 F250 T251	D249-K253 VanDerWaalsContact O-CD 3.26Å; D249-K253 WeakPolarHBondContact O-CD 3.49Å; D249-K253 VanDerWaalsContact O-CE 3.24Å; D249-K253 WeakPolarHBondContact O-CE 3.36Å; D249-K253 VanDerWaalsContact O-CG 3.31Å; D249-K253 WeakPolarHBondContact O-CG 3.31Å; F250-K253 WeakPolarHBondContact O-CB 3.29Å; F250-K253 PolarHBondContact O-N 3.39Å; T251-K253 PolarHBondContact O-N 2.96Å
254	Q	98.5	Very high	98.5	Very high	35 Å²	35	43.7 Å²	43.7	16%	0.164	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-13.4	175.9	-55.9	179.2	-11.6	0	0	112.4	L227 F228 F250 T251 V252	L227-Q254 CarbonylContact C-O 3.44Å; L227-Q254 HydrophobicContact CB-CB 4.24Å; L227-Q254 HydrophobicContact CD1-CB 4.24Å; F228-Q254 WeakPolarHBondContact CA-O 3.31Å; F228-Q254 PolarHBondContact N-O 3.29Å; F250-Q254 VanDerWaalsContact CZ-NE2 3.35Å; T251-Q254 WeakPolarHBondContact O-CB 3.35Å; T251-Q254 PolarHBondContact O-N 2.88Å; V252-Q254 PolarHBondContact O-N 3.13Å
255	M	98.8	Very high	98.4	Very high	16 Å²	16	38.6 Å²	38.6	8%	0.079	19%	0.185	C	C	.	.	S	Bend	trans	-70.2	152.2	174.8	-63.2	178.9	67	0	0	110.8	L227 V233 T251 V252 A259 L261 I284	L227-M255 HydrophobicContact CB-CG 4.13Å; L227-M255 HydrophobicContact CD2-CG 3.93Å; L227-M255 HydrophobicContact CG-CG 4.4Å; V233-M255 HydrophobicContact CB-CE 4.07Å; V233-M255 HydrophobicContact CG2-CE 3.87Å; T251-M255 PolarHBondContact O-N 2.74Å; V252-M255 HydrophobicContact CG1-SD 4.4Å; V252-M255 WeakPolarHBondContact O-CB 3.36Å; V252-M255 PolarHBondContact O-N 3.08Å; M255-A259 HydrophobicContact CE-CB 4.11Å; M255-L261 HydrophobicContact CE-CB 4.42Å; M255-L261 HydrophobicContact CE-CD1 4.47Å; M255-I284 HydrophobicContact CE-CD1 4.2Å; M255-I284 HydrophobicContact CE-CG1 4.36Å; M255-I284 HydrophobicContact SD-CD1 3.98Å; M255-I284 HydrophobicContact SD-CG1 4.43Å
256	R	98.2	Very high	98.4	Very high	88 Å²	88	39.5 Å²	39.5	33%	0.332	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-58.2	143.2	171.5	-69.5	-172.3	171	178	0.1	111.3	F228 H229 D231 G258 A259	F228-R256 WeakPolarHBondContact O-CG 3.39Å; F228-R256 PolarHBondContact O-NE 3.23Å; H229-R256 VanDerWaalsContact O-CZ 3.27Å; H229-R256 PolarHBondContact O-NH2 2.81Å; D231-R256 WeakPolarHBondContact OD1-CD 3.37Å; D231-R256 IonicContact OD1-CZ 3.71Å; D231-R256 IonicContact OD1-NE 3.97Å; D231-R256 IonicContact OD1-NH1 2.71Å; D231-R256 PolarHBondContact OD1-NH1 3.05Å; D231-R256 IonicContact OD2-NH1 3.33Å; D231-R256 PolarHBondContact OD2-NH1 2.72Å; R256-G258 PolarHBondContact O-N 3Å; R256-A259 HydrophobicContact CB-CB 4.23Å; R256-A259 WeakPolarHBondContact O-CB 3.38Å; R256-A259 PolarHBondContact O-N 3.1Å; R256-A259 VanDerWaalsContact O-N 3.08Å
257	Q	98.1	Very high	98.4	Very high	138 Å²	138	38.4 Å²	38.4	65%	0.645	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	124.4	172	-175.2	68.5	30	0	0	110	A259 G282	Q257-A259 VanDerWaalsContact C-N 3.33Å; Q257-G282 PolarHBondContact NE2-O 3.23Å
258	G	96.3	Very high	98.3	Very high	14 Å²	14	38.9 Å²	38.9	14%	0.144	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	20.7	-179.1	0	0	0	0	0	114.2	R256 R283 R285	R256-G258 PolarHBondContact O-N 3Å; G258-R283 PolarHBondContact N-O 2.85Å; G258-R285 WeakPolarHBondContact O-CB 3.4Å; G258-R285 PolarHBondContact O-NE 3.44Å; G258-R285 VanDerWaalsContact O-NE 3.15Å
259	A	98.5	Very high	98.3	Very high	2 Å²	2	36.8 Å²	36.8	2%	0.017	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	160.9	171.6	0	0	0	0	0	112.1	D231 M255 R256 Q257 I284 R285	D231-A259 CarbonylContact O-C 3.52Å; D231-A259 WeakPolarHBondContact O-CA 3.46Å; D231-A259 WeakPolarHBondContact O-CB 3.49Å; M255-A259 HydrophobicContact CE-CB 4.11Å; R256-A259 HydrophobicContact CB-CB 4.23Å; R256-A259 WeakPolarHBondContact O-CB 3.38Å; R256-A259 PolarHBondContact O-N 3.1Å; R256-A259 VanDerWaalsContact O-N 3.08Å; Q257-A259 VanDerWaalsContact C-N 3.33Å; A259-I284 CarbonylContact O-C 3.58Å; A259-I284 WeakPolarHBondContact O-CA 3.5Å; A259-I284 WeakPolarHBondContact O-CG2 3.47Å; A259-R285 PolarHBondContact O-N 3.45Å
260	F	98.9	Very high	98.4	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.018	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	150.4	170.8	-70.7	-56.5	0	0	0	111.8	L139 Y140 D231 C232 V233 R285 G286	L139-F260 HydrophobicContact CB-CD1 3.83Å; L139-F260 HydrophobicContact CB-CD2 4.31Å; L139-F260 HydrophobicContact CB-CE1 3.87Å; L139-F260 HydrophobicContact CB-CE2 4.34Å; L139-F260 HydrophobicContact CB-CG 4.04Å; L139-F260 HydrophobicContact CB-CZ 4.11Å; L139-F260 HydrophobicContact CD1-CB 3.89Å; L139-F260 HydrophobicContact CD1-CD1 4Å; L139-F260 HydrophobicContact CD1-CG 4.08Å; L139-F260 HydrophobicContact CD2-CD1 4.24Å; L139-F260 HydrophobicContact CD2-CE1 4.41Å; L139-F260 HydrophobicContact CG-CD1 4.25Å; L139-F260 WeakPolarHBondContact O-CZ 3.41Å; Y140-F260 HydrophobicContact CD1-CE2 4.15Å; Y140-F260 HydrophobicContact CD2-CD2 4.05Å; Y140-F260 HydrophobicContact CD2-CE2 4.08Å; Y140-F260 HydrophobicContact CE1-CD2 4.33Å; Y140-F260 HydrophobicContact CE1-CE2 4.08Å; Y140-F260 AromaticContact CE2-CD2 3.67Å; Y140-F260 HydrophobicContact CE2-CD2 3.67Å; Y140-F260 HydrophobicContact CE2-CE2 4.05Å; Y140-F260 HydrophobicContact CG-CE2 4.14Å; Y140-F260 AromaticContact CZ-CD2 3.82Å; D231-F260 PolarHBondContact O-N 2.99Å; C232-F260 WeakPolarHBondContact CA-O 3.5Å; C232-F260 HydrophobicContact CB-CB 4.06Å; V233-F260 PolarHBondContact N-O 3.24Å; F260-R285 HydrophobicContact CD1-CB 4.21Å; F260-R285 HydrophobicContact CD1-CG 4.5Å; F260-R285 HydrophobicContact CE1-CB 3.94Å; F260-R285 HydrophobicContact CE1-CG 3.74Å; F260-R285 HydrophobicContact CZ-CG 4.09Å; F260-G286 WeakPolarHBondContact CA-O 3.42Å
261	L	98.9	Very high	98.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	133	172.8	-177.7	65	0	0	0	110.9	V233 I247 M255 V270 L275 G286 A287 A288	V233-L261 HydrophobicContact CB-CD1 4.12Å; V233-L261 HydrophobicContact CG1-CD1 4.07Å; V233-L261 CarbonylContact O-C 3.45Å; V233-L261 WeakPolarHBondContact O-CA 3.19Å; I247-L261 HydrophobicContact CG2-CD2 4.14Å; M255-L261 HydrophobicContact CE-CB 4.42Å; M255-L261 HydrophobicContact CE-CD1 4.47Å; L261-V270 HydrophobicContact CD2-CG1 4.26Å; L261-V270 HydrophobicContact CD2-CG2 4.4Å; L261-L275 HydrophobicContact CD2-CD1 3.84Å; L261-L275 HydrophobicContact CD2-CD2 4.17Å; L261-G286 PolarHBondContact N-O 3.4Å; L261-G286 VanDerWaalsContact N-O 3.15Å; L261-A287 HydrophobicContact CB-CB 4.28Å; L261-A287 CarbonylContact O-C 3.53Å; L261-A287 WeakPolarHBondContact O-CA 3.5Å; L261-A288 PolarHBondContact O-N 2.9Å
262	V	98.9	Very high	98.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.2	174.7	-179.6	0	0	0	0	109.9	T132 H135 I136 L139 V233 T234 L235 T264 A288	T132-V262 HydrophobicContact CG2-CG1 4.1Å; H135-V262 HydrophobicContact CB-CG1 3.94Å; I136-V262 HydrophobicContact CG1-CB 4.48Å; I136-V262 HydrophobicContact CG1-CG2 3.81Å; L139-V262 HydrophobicContact CD1-CG2 3.66Å; V233-V262 PolarHBondContact O-N 2.9Å; T234-V262 VanDerWaalsContact CA-O 3.31Å; T234-V262 WeakPolarHBondContact CA-O 3.36Å; L235-V262 PolarHBondContact N-O 3.37Å; V262-T264 HydrophobicContact CG1-CG2 4.23Å; V262-A288 VanDerWaalsContact CA-O 3.32Å; V262-A288 WeakPolarHBondContact CA-O 3.41Å; V262-A288 HydrophobicContact CG2-CB 4.38Å
263	N	98.9	Very high	98.1	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	109.6	175.2	-170.9	10.5	0	0	0	110.9	L235 A265 R266 V270 A288 L289 D290 V291	L235-N263 HydrophobicContact CD1-CB 4.16Å; N263-A265 PolarHBondContact OD1-N 3.19Å; N263-R266 PolarHBondContact ND2-O 3.22Å; N263-R266 PolarHBondContact OD1-N 3.09Å; N263-V270 HydrophobicContact CB-CG2 4.41Å; N263-A288 PolarHBondContact N-O 3.3Å; N263-L289 HydrophobicContact CB-CD2 3.66Å; N263-D290 PolarHBondContact O-N 3.04Å; N263-V291 HydrophobicContact CB-CG2 4.39Å
264	T	98.7	Very high	98.1	Very high	12 Å²	12	31.8 Å²	31.8	7%	0.074	15%	0.153	C	C	.	.			trans	-122.1	21.9	170	66.2	0	0	0	0	110.6	T132 V262 D290	T132-T264 PolarHBondContact OG1-OG1 3.3Å; T132-T264 VanDerWaalsContact OG1-OG1 3.04Å; V262-T264 HydrophobicContact CG1-CG2 4.23Å; T264-D290 HydrophobicContact CG2-CB 3.92Å
265	A	98.4	Very high	98	Very high	10 Å²	10	30.4 Å²	30.4	8%	0.083	15%	0.146	C	C	.	.	S	Bend	trans	-100.1	-84.4	-178.3	0	0	0	0	0	110.5	L235 N263 L269	L235-A265 HydrophobicContact CB-CB 4.23Å; L235-A265 VanDerWaalsContact O-CB 3.32Å; L235-A265 WeakPolarHBondContact O-CB 3.29Å; N263-A265 PolarHBondContact OD1-N 3.19Å; A265-L269 HydrophobicContact CB-CD1 3.66Å
266	R	98.4	Very high	97.9	Very high	55 Å²	55	30.5 Å²	30.5	21%	0.208	15%	0.15	C	C	.	.			trans	-145	143.7	178.1	-68.8	-62.8	-179.3	-105.5	17.1	111	D103 L239 N263 L269 V291	D103-R266 IonicContact OD1-CZ 2.68Å; D103-R266 IonicContact OD1-NE 3.07Å; D103-R266 PolarHBondContact OD1-NE 3.41Å; D103-R266 IonicContact OD1-NH2 3.21Å; D103-R266 VanDerWaalsContact OD2-CD 3.27Å; D103-R266 WeakPolarHBondContact OD2-CD 3.49Å; D103-R266 IonicContact OD2-NE 2.7Å; D103-R266 PolarHBondContact OD2-NE 2.8Å; L239-R266 HydrophobicContact CB-CB 3.85Å; L239-R266 HydrophobicContact CB-CG 3.84Å; L239-R266 HydrophobicContact CD2-CB 4.44Å; N263-R266 PolarHBondContact ND2-O 3.22Å; N263-R266 PolarHBondContact OD1-N 3.09Å; R266-L269 HydrophobicContact CB-CD1 4.13Å; R266-L269 HydrophobicContact CB-CG 4.16Å; R266-L269 WeakPolarHBondContact O-CB 3.41Å; R266-L269 PolarHBondContact O-N 3.14Å; R266-V291 VanDerWaalsContact C-CG2 3.43Å
267	G	97.3	Very high	97.8	Very high	7 Å²	7	30.2 Å²	30.2	7%	0.072	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-57.3	-52.1	-178.7	0	0	0	0	0	113.3	L269 V270 H292	G267-L269 PolarHBondContact O-N 2.79Å; G267-V270 PolarHBondContact O-N 3.48Å; G267-H292 VanDerWaalsContact CA-C 3.4Å; G267-H292 WeakPolarHBondContact CA-O 3.25Å
268	G	97.8	Very high	97.8	Very high	12 Å²	12	23.7 Å²	23.7	12%	0.124	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-64.2	3.7	-178.7	0	0	0	0	0	116.4	H244 H245 V270	H244-G268 WeakPolarHBondContact CA-O 3.32Å; H245-G268 PolarHBondContact N-O 3.39Å; G268-V270 VanDerWaalsContact C-N 3.33Å
269	L	98.8	Very high	97.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-78.9	-19.7	169.3	-66.1	171.3	0	0	0	112.5	L235 L239 N243 H245 L246 I247 A265 R266 G267	L235-L269 HydrophobicContact CB-CD1 4.38Å; L235-L269 HydrophobicContact CD1-CB 3.91Å; L235-L269 HydrophobicContact CD1-CD1 4.33Å; L239-L269 HydrophobicContact CB-CD2 4.44Å; L239-L269 HydrophobicContact CD1-CD2 3.86Å; L239-L269 HydrophobicContact CD1-CG 4.31Å; N243-L269 HydrophobicContact CB-CD2 4.35Å; N243-L269 WeakPolarHBondContact O-CD2 3.35Å; H245-L269 CarbonylContact C-O 3.54Å; L246-L269 PolarHBondContact N-O 2.87Å; I247-L269 PolarHBondContact N-O 2.85Å; A265-L269 HydrophobicContact CB-CD1 3.66Å; R266-L269 HydrophobicContact CB-CD1 4.13Å; R266-L269 HydrophobicContact CB-CG 4.16Å; R266-L269 WeakPolarHBondContact O-CB 3.41Å; R266-L269 PolarHBondContact O-N 3.14Å; G267-L269 PolarHBondContact O-N 2.79Å
270	V	98.8	Very high	97.7	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.018	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-122.3	126.3	-175.4	-177.3	0	0	0	0	109	L235 I247 L261 N263 G267 G268 E272 L275 E293	L235-V270 HydrophobicContact CD1-CG2 3.5Å; L235-V270 VanDerWaalsContact CD1-CG2 3.5Å; I247-V270 HydrophobicContact CB-CB 4.44Å; I247-V270 HydrophobicContact CB-CG1 4.29Å; I247-V270 HydrophobicContact CB-CG2 4.12Å; I247-V270 HydrophobicContact CG1-CG2 4.31Å; I247-V270 HydrophobicContact CG2-CG1 4.28Å; I247-V270 WeakPolarHBondContact O-CA 3.45Å; L261-V270 HydrophobicContact CD2-CG1 4.26Å; L261-V270 HydrophobicContact CD2-CG2 4.4Å; N263-V270 HydrophobicContact CB-CG2 4.41Å; G267-V270 PolarHBondContact O-N 3.48Å; G268-V270 VanDerWaalsContact C-N 3.33Å; V270-E272 PolarHBondContact O-N 3.29Å; V270-L275 HydrophobicContact CG1-CB 4.05Å; V270-L275 HydrophobicContact CG1-CD2 3.94Å; V270-E293 VanDerWaalsContact O-OE1 3.12Å
271	D	98.3	Very high	97.6	Very high	28 Å²	28	33.5 Å²	33.5	15%	0.15	16%	0.163	C	C	.	.			trans	-72.2	106.8	166.3	-172.2	-45.8	0	0	0	109.1	H245 I247 N248 K273 A274 L275 E293	H245-D271 HydrophobicContact CB-CB 4.29Å; H245-D271 IonicContact CE1-OD2 2.77Å; H245-D271 WeakPolarHBondContact ND1-CB 3.27Å; H245-D271 IonicContact ND1-OD2 3.97Å; H245-D271 PolarHBondContact ND1-OD2 2.82Å; I247-D271 PolarHBondContact O-N 3.34Å; N248-D271 HydrophobicContact CB-CB 4.25Å; D271-K273 PolarHBondContact O-N 3.03Å; D271-K273 WeakPolarHBondContact OD1-CB 3.5Å; D271-K273 PolarHBondContact OD1-N 2.87Å; D271-A274 HydrophobicContact CB-CB 3.96Å; D271-A274 PolarHBondContact O-N 3.07Å; D271-A274 PolarHBondContact OD1-N 3.22Å; D271-A274 VanDerWaalsContact OD1-N 3.07Å; D271-L275 PolarHBondContact O-N 2.9Å; D271-E293 WeakPolarHBondContact CA-OE1 3.31Å
272	E	96.2	Very high	97.3	Very high	65 Å²	65	35.1 Å²	35.1	30%	0.304	18%	0.18	S	C	.	.	H	α-helix	trans	-64.7	-27.6	-175.4	-73.2	-174.4	-173	0	0	112.6	V270 A276 H292 E293	V270-E272 PolarHBondContact O-N 3.29Å; E272-A276 WeakPolarHBondContact O-CB 3.39Å; E272-A276 PolarHBondContact O-N 3.28Å; E272-H292 WeakPolarHBondContact OE1-CA 3.34Å; E272-H292 WeakPolarHBondContact OE1-CB 3.23Å; E272-H292 IonicContact OE1-CD2 3.95Å; E272-E293 HydrophobicContact CG-CB 4.4Å; E272-E293 HydrophobicContact CG-CG 4.07Å; E272-E293 PolarHBondContact N-OE1 3.45Å; E272-E293 PolarHBondContact OE1-N 3.17Å
273	K	95.7	Very high	97.2	Very high	176 Å²	176	37 Å²	37	77%	0.765	19%	0.187	S	C	*	.	H	α-helix	trans	-71.2	-45.5	177.5	-63	174.4	-176.7	166	0	110.5	D271 L275 A276 Q277	D271-K273 PolarHBondContact O-N 3.03Å; D271-K273 WeakPolarHBondContact OD1-CB 3.5Å; D271-K273 PolarHBondContact OD1-N 2.87Å; K273-L275 VanDerWaalsContact C-N 3.32Å; K273-L275 PolarHBondContact O-N 2.85Å; K273-A276 PolarHBondContact O-N 3.4Å; K273-Q277 PolarHBondContact O-N 3.33Å
274	A	96.9	Very high	97.2	Very high	1 Å²	1	37 Å²	37	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-62	-42	176	0	0	0	0	0	111.4	D249 D271 Q277 A278	D249-A274 HydrophobicContact CB-CB 4.25Å; D249-A274 VanDerWaalsContact N-CB 3.35Å; D271-A274 HydrophobicContact CB-CB 3.96Å; D271-A274 PolarHBondContact O-N 3.07Å; D271-A274 PolarHBondContact OD1-N 3.22Å; D271-A274 VanDerWaalsContact OD1-N 3.07Å; A274-Q277 PolarHBondContact O-N 3.12Å; A274-A278 WeakPolarHBondContact O-CB 3.04Å; A274-A278 PolarHBondContact O-N 3.04Å
275	L	97.9	Very high	97.1	Very high	6 Å²	6	40.6 Å²	40.6	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-47.5	176.2	178.2	58.7	0	0	0	111.9	L261 V270 D271 K273 Q277 A278 L279 I284 A287 L289	L261-L275 HydrophobicContact CD2-CD1 3.84Å; L261-L275 HydrophobicContact CD2-CD2 4.17Å; V270-L275 HydrophobicContact CG1-CB 4.05Å; V270-L275 HydrophobicContact CG1-CD2 3.94Å; D271-L275 PolarHBondContact O-N 2.9Å; K273-L275 VanDerWaalsContact C-N 3.32Å; K273-L275 PolarHBondContact O-N 2.85Å; L275-Q277 VanDerWaalsContact C-N 3.3Å; L275-Q277 PolarHBondContact O-N 2.8Å; L275-A278 WeakPolarHBondContact O-CB 3.27Å; L275-A278 PolarHBondContact O-N 3.48Å; L275-A278 VanDerWaalsContact O-N 3.1Å; L275-L279 HydrophobicContact CD1-CD1 4.2Å; L275-L279 HydrophobicContact CD1-CG 4.23Å; L275-L279 HydrophobicContact CG-CD1 4.05Å; L275-L279 WeakPolarHBondContact O-CG 3.42Å; L275-L279 PolarHBondContact O-N 2.88Å; L275-I284 HydrophobicContact CD1-CD1 3.53Å; L275-I284 HydrophobicContact CD1-CG2 4.37Å; L275-A287 HydrophobicContact CD1-CB 4.12Å; L275-A287 HydrophobicContact CD2-CB 4.1Å; L275-L289 HydrophobicContact CD2-CD1 3.84Å; L275-L289 HydrophobicContact CD2-CD2 4.18Å; L275-L289 HydrophobicContact CD2-CG 4.48Å
276	A	96.3	Very high	97.1	Very high	18 Å²	18	40.1 Å²	40.1	15%	0.149	20%	0.195	C	C	.	.	H	α-helix	trans	-59.2	-41.9	178.6	0	0	0	0	0	111.7	E272 K273 L279 K280	E272-A276 WeakPolarHBondContact O-CB 3.39Å; E272-A276 PolarHBondContact O-N 3.28Å; K273-A276 PolarHBondContact O-N 3.4Å; A276-L279 PolarHBondContact O-N 3.26Å; A276-K280 VanDerWaalsContact O-CG 3.29Å; A276-K280 WeakPolarHBondContact O-CG 3.41Å; A276-K280 PolarHBondContact O-N 3.1Å
277	Q	96.4	Very high	97.1	Very high	83 Å²	83	38.3 Å²	38.3	39%	0.388	19%	0.192	S	C	.	.	H	α-helix	trans	-65.7	-39.8	175.2	-170.4	61.8	23	0	0	111.8	K273 A274 L275 L279 K280 E281	K273-Q277 PolarHBondContact O-N 3.33Å; A274-Q277 PolarHBondContact O-N 3.12Å; L275-Q277 VanDerWaalsContact C-N 3.3Å; L275-Q277 PolarHBondContact O-N 2.8Å; Q277-L279 PolarHBondContact O-N 2.95Å; Q277-K280 PolarHBondContact O-N 3.22Å; Q277-E281 HydrophobicContact CG-CG 4.48Å; Q277-E281 WeakPolarHBondContact CG-OE1 3.36Å; Q277-E281 PolarHBondContact NE2-OE1 3.28Å; Q277-E281 WeakPolarHBondContact O-CB 3.29Å; Q277-E281 WeakPolarHBondContact O-CG 3.21Å; Q277-E281 PolarHBondContact O-N 2.9Å
278	A	97.6	Very high	97.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.6	-36.1	178.4	0	0	0	0	0	113.7	V252 A274 L275 G282 R283 I284	V252-A278 HydrophobicContact CG1-CB 3.59Å; A274-A278 WeakPolarHBondContact O-CB 3.04Å; A274-A278 PolarHBondContact O-N 3.04Å; L275-A278 WeakPolarHBondContact O-CB 3.27Å; L275-A278 PolarHBondContact O-N 3.48Å; L275-A278 VanDerWaalsContact O-N 3.1Å; A278-G282 PolarHBondContact O-N 3.2Å; A278-R283 HydrophobicContact CB-CB 4.33Å; A278-R283 PolarHBondContact O-N 3.46Å; A278-I284 HydrophobicContact CB-CB 4.24Å; A278-I284 HydrophobicContact CB-CD1 3.98Å; A278-I284 HydrophobicContact CB-CG1 4.05Å; A278-I284 PolarHBondContact O-N 3.47Å; A278-I284 VanDerWaalsContact O-N 3.13Å
279	L	96.6	Very high	97.2	Very high	30 Å²	30	40.2 Å²	40.2	16%	0.157	20%	0.2	C	C	.	.	H	α-helix	trans	-66.6	-47.3	172.5	-70.9	164.7	0	0	0	110.6	L275 A276 Q277 E281 G282 I284 A287	L275-L279 HydrophobicContact CD1-CD1 4.2Å; L275-L279 HydrophobicContact CD1-CG 4.23Å; L275-L279 HydrophobicContact CG-CD1 4.05Å; L275-L279 WeakPolarHBondContact O-CG 3.42Å; L275-L279 PolarHBondContact O-N 2.88Å; A276-L279 PolarHBondContact O-N 3.26Å; Q277-L279 PolarHBondContact O-N 2.95Å; L279-E281 VanDerWaalsContact C-N 3.27Å; L279-E281 PolarHBondContact O-N 3.35Å; L279-G282 PolarHBondContact O-N 2.87Å; L279-I284 HydrophobicContact CD2-CB 4.26Å; L279-I284 HydrophobicContact CD2-CG2 3.72Å; L279-I284 HydrophobicContact CG-CG2 4.41Å; L279-A287 HydrophobicContact CD1-CB 4.44Å; L279-A287 HydrophobicContact CD2-CB 4.42Å
280	K	96.1	Very high	97.2	Very high	96 Å²	96	44.8 Å²	44.8	42%	0.417	22%	0.224	S	C	.	.	H	α-helix	trans	-56.5	-39.2	176.1	-74.8	170	-178	177.3	0	113.1	A276 Q277 G282 L307	A276-K280 VanDerWaalsContact O-CG 3.29Å; A276-K280 WeakPolarHBondContact O-CG 3.41Å; A276-K280 PolarHBondContact O-N 3.1Å; Q277-K280 PolarHBondContact O-N 3.22Å; K280-G282 VanDerWaalsContact C-N 3.32Å; K280-L307 VanDerWaalsContact CA-CD2 3.47Å; K280-L307 HydrophobicContact CB-CD2 3.93Å; K280-L307 HydrophobicContact CD-CD1 4.5Å; K280-L307 HydrophobicContact CG-CD1 3.9Å; K280-L307 HydrophobicContact CG-CD2 3.29Å; K280-L307 HydrophobicContact CG-CG 4.24Å
281	E	96.1	Very high	97.1	Very high	100 Å²	100	45.5 Å²	45.5	47%	0.467	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.5	-179.5	-68.3	173	176.1	0	0	113.3	Q277 L279 R283	Q277-E281 HydrophobicContact CG-CG 4.48Å; Q277-E281 WeakPolarHBondContact CG-OE1 3.36Å; Q277-E281 PolarHBondContact NE2-OE1 3.28Å; Q277-E281 WeakPolarHBondContact O-CB 3.29Å; Q277-E281 WeakPolarHBondContact O-CG 3.21Å; Q277-E281 PolarHBondContact O-N 2.9Å; L279-E281 VanDerWaalsContact C-N 3.27Å; L279-E281 PolarHBondContact O-N 3.35Å; E281-R283 HydrophobicContact CB-CG 4.39Å; E281-R283 PolarHBondContact O-N 2.97Å; E281-R283 IonicContact OE2-CZ 3.13Å; E281-R283 IonicContact OE2-NE 2.69Å; E281-R283 PolarHBondContact OE2-NE 2.86Å; E281-R283 IonicContact OE2-NH2 2.74Å; E281-R283 PolarHBondContact OE2-NH2 2.94Å
282	G	94.1	Very high	97.1	Very high	35 Å²	35	45.5 Å²	45.5	36%	0.361	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	13.4	-176.3	0	0	0	0	0	114.5	Q257 A278 L279 K280	Q257-G282 PolarHBondContact NE2-O 3.23Å; A278-G282 PolarHBondContact O-N 3.2Å; L279-G282 PolarHBondContact O-N 2.87Å; K280-G282 VanDerWaalsContact C-N 3.32Å
283	R	96.6	Very high	97	Very high	39 Å²	39	46.7 Å²	46.7	15%	0.147	23%	0.233	C	C	.	.	S	Bend	trans	-65.3	-42.5	171.7	-77.5	-171.6	-72.8	105.2	-1.8	111	G258 A278 E281	G258-R283 PolarHBondContact N-O 2.85Å; A278-R283 HydrophobicContact CB-CB 4.33Å; A278-R283 PolarHBondContact O-N 3.46Å; E281-R283 HydrophobicContact CB-CG 4.39Å; E281-R283 PolarHBondContact O-N 2.97Å; E281-R283 IonicContact OE2-CZ 3.13Å; E281-R283 IonicContact OE2-NE 2.69Å; E281-R283 PolarHBondContact OE2-NE 2.86Å; E281-R283 IonicContact OE2-NH2 2.74Å; E281-R283 PolarHBondContact OE2-NH2 2.94Å
284	I	98.3	Very high	96.8	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.3	166.2	-71	177.4	0	0	0	106.8	V252 M255 A259 L275 A278 L279 G286	V252-I284 HydrophobicContact CG1-CD1 3.72Å; V252-I284 HydrophobicContact CG1-CG1 4.15Å; M255-I284 HydrophobicContact CE-CD1 4.2Å; M255-I284 HydrophobicContact CE-CG1 4.36Å; M255-I284 HydrophobicContact SD-CD1 3.98Å; M255-I284 HydrophobicContact SD-CG1 4.43Å; A259-I284 CarbonylContact O-C 3.58Å; A259-I284 WeakPolarHBondContact O-CA 3.5Å; A259-I284 WeakPolarHBondContact O-CG2 3.47Å; L275-I284 HydrophobicContact CD1-CD1 3.53Å; L275-I284 HydrophobicContact CD1-CG2 4.37Å; A278-I284 HydrophobicContact CB-CB 4.24Å; A278-I284 HydrophobicContact CB-CD1 3.98Å; A278-I284 HydrophobicContact CB-CG1 4.05Å; A278-I284 PolarHBondContact O-N 3.47Å; A278-I284 VanDerWaalsContact O-N 3.13Å; L279-I284 HydrophobicContact CD2-CB 4.26Å; L279-I284 HydrophobicContact CD2-CG2 3.72Å; L279-I284 HydrophobicContact CG-CG2 4.41Å; I284-G286 VanDerWaalsContact C-N 3.34Å; I284-G286 VanDerWaalsContact CG2-O 3.29Å; I284-G286 WeakPolarHBondContact CG2-O 3.27Å
285	R	97.6	Very high	96.6	Very high	87 Å²	87	46.6 Å²	46.6	33%	0.328	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-28	-178.5	-179.7	-171.2	-62.2	-95.6	3.7	112.3	G258 A259 F260	G258-R285 WeakPolarHBondContact O-CB 3.4Å; G258-R285 PolarHBondContact O-NE 3.44Å; G258-R285 VanDerWaalsContact O-NE 3.15Å; A259-R285 PolarHBondContact O-N 3.45Å; F260-R285 HydrophobicContact CD1-CB 4.21Å; F260-R285 HydrophobicContact CD1-CG 4.5Å; F260-R285 HydrophobicContact CE1-CB 3.94Å; F260-R285 HydrophobicContact CE1-CG 3.74Å; F260-R285 HydrophobicContact CZ-CG 4.09Å
286	G	97.4	Very high	96.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.1	155.8	178.6	0	0	0	0	0	111.2	F260 L261 I284	F260-G286 WeakPolarHBondContact CA-O 3.42Å; L261-G286 PolarHBondContact N-O 3.4Å; L261-G286 VanDerWaalsContact N-O 3.15Å; I284-G286 VanDerWaalsContact C-N 3.34Å; I284-G286 VanDerWaalsContact CG2-O 3.29Å; I284-G286 WeakPolarHBondContact CG2-O 3.27Å
287	A	98.6	Very high	96.1	Very high	17 Å²	17	55.6 Å²	55.6	14%	0.14	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	148.7	174.8	0	0	0	0	0	110.7	L261 L275 L279	L261-A287 HydrophobicContact CB-CB 4.28Å; L261-A287 CarbonylContact O-C 3.53Å; L261-A287 WeakPolarHBondContact O-CA 3.5Å; L275-A287 HydrophobicContact CD1-CB 4.12Å; L275-A287 HydrophobicContact CD2-CB 4.1Å; L279-A287 HydrophobicContact CD1-CB 4.44Å; L279-A287 HydrophobicContact CD2-CB 4.42Å
288	A	98.6	Very high	95.6	Very high	13 Å²	13	61.4 Å²	61.4	11%	0.107	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	116	171.5	0	0	0	0	0	108.9	H135 L139 L261 V262 N263	H135-A288 HydrophobicContact CB-CB 3.68Å; L139-A288 HydrophobicContact CD1-CB 4Å; L139-A288 HydrophobicContact CD2-CB 4.29Å; L139-A288 HydrophobicContact CG-CB 4.15Å; L261-A288 PolarHBondContact O-N 2.9Å; V262-A288 VanDerWaalsContact CA-O 3.32Å; V262-A288 WeakPolarHBondContact CA-O 3.41Å; V262-A288 HydrophobicContact CG2-CB 4.38Å; N263-A288 PolarHBondContact N-O 3.3Å
289	L	98.4	Very high	94.3	Very high	46 Å²	46	65.6 Å²	65.6	24%	0.241	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.5	-174.5	-50.8	178.2	0	0	0	108.7	N263 L275	N263-L289 HydrophobicContact CB-CD2 3.66Å; L275-L289 HydrophobicContact CD2-CD1 3.84Å; L275-L289 HydrophobicContact CD2-CD2 4.18Å; L275-L289 HydrophobicContact CD2-CG 4.48Å
290	D	98	Very high	92.8	Very high	96 Å²	96	66.8 Å²	66.8	51%	0.513	34%	0.343	S	S	.	.	S	Bend	trans	-94.6	-14.7	169.9	-174.1	57.1	0	0	0	111	N263 T264	N263-D290 PolarHBondContact O-N 3.04Å; T264-D290 HydrophobicContact CG2-CB 3.92Å
291	V	97.9	Very high	90.8	Very high	17 Å²	17	68.5 Å²	68.5	10%	0.103	36%	0.364	C	S	.	.			trans	-134.8	148.4	-176.6	-65.4	0	0	0	0	110.4	N263 R266 E295	N263-V291 HydrophobicContact CB-CG2 4.39Å; R266-V291 VanDerWaalsContact C-CG2 3.43Å; V291-E295 VanDerWaalsContact CA-OE1 3.22Å; V291-E295 WeakPolarHBondContact CA-OE1 3.02Å; V291-E295 WeakPolarHBondContact CB-OE1 3.45Å
292	H	97.4	Very high	88.4	Confident	29 Å²	29	73.5 Å²	73.5	13%	0.134	38%	0.378	C	S	.	.			trans	-138.4	155.2	-170.8	-58.1	83.2	0	0	0	111	G267 E272 S294 E295 F297	G267-H292 VanDerWaalsContact CA-C 3.4Å; G267-H292 WeakPolarHBondContact CA-O 3.25Å; E272-H292 WeakPolarHBondContact OE1-CA 3.34Å; E272-H292 WeakPolarHBondContact OE1-CB 3.23Å; E272-H292 IonicContact OE1-CD2 3.95Å; H292-S294 PolarHBondContact O-N 3.17Å; H292-E295 HydrophobicContact CB-CG 4.12Å; H292-E295 PolarHBondContact N-OE1 2.82Å; H292-F297 HydrophobicContact CB-CD2 4.17Å; H292-F297 AromaticContact CD2-CD2 3.14Å; H292-F297 WeakPolarHBondContact CD2-CD2 3.16Å; H292-F297 AromaticContact CD2-CE2 3.52Å; H292-F297 AromaticContact CD2-CG 3.8Å; H292-F297 AromaticContact CE1-CD2 3.93Å; H292-F297 AromaticContact CE1-CG 3.78Å; H292-F297 AromaticContact CG-CD2 3.49Å; H292-F297 VanDerWaalsContact CG-CD2 3.49Å; H292-F297 AromaticContact CG-CG 3.93Å; H292-F297 AromaticContact ND1-CD2 3.97Å; H292-F297 AromaticContact ND1-CG 3.92Å; H292-F297 AromaticContact NE2-CD2 3.45Å; H292-F297 WeakPolarHBondContact NE2-CD2 3.21Å; H292-F297 AromaticContact NE2-CE2 3.73Å; H292-F297 AromaticContact NE2-CG 3.69Å
293	E	93.9	Very high	86.2	Confident	89 Å²	89	75.7 Å²	75.7	42%	0.416	38%	0.38	S	S	.	.	S	Bend	trans	-56.4	-36.3	177.4	-81.1	-174	-133.1	0	0	111.6	H245 V270 D271 E272	H245-E293 IonicContact CE1-OE1 3.02Å; H245-E293 IonicContact NE2-OE1 3.99Å; H245-E293 IonicContact NE2-OE2 3.71Å; V270-E293 VanDerWaalsContact O-OE1 3.12Å; D271-E293 WeakPolarHBondContact CA-OE1 3.31Å; E272-E293 HydrophobicContact CG-CB 4.4Å; E272-E293 HydrophobicContact CG-CG 4.07Å; E272-E293 PolarHBondContact N-OE1 3.45Å; E272-E293 PolarHBondContact OE1-N 3.17Å
294	S	93.1	Very high	83.5	Confident	90 Å²	90	77.2 Å²	77.2	63%	0.629	39%	0.394	S	S	*	.	S	Bend	trans	-124	118.3	175.9	178.9	0	0	0	0	110.4	H292	H292-S294 PolarHBondContact O-N 3.17Å
295	E	92.7	Very high	81	Confident	86 Å²	86	83.1 Å²	83.1	40%	0.402	42%	0.422	S	S	.	.	S	Bend	trans	-116.1	140.9	177.3	-69.1	178.4	-159.3	0	0	110.9	H77 V291 H292	H77-E295 IonicContact CD2-OE2 3.59Å; H77-E295 IonicContact NE2-OE2 2.68Å; V291-E295 VanDerWaalsContact CA-OE1 3.22Å; V291-E295 WeakPolarHBondContact CA-OE1 3.02Å; V291-E295 WeakPolarHBondContact CB-OE1 3.45Å; H292-E295 HydrophobicContact CB-CG 4.12Å; H292-E295 PolarHBondContact N-OE1 2.82Å
296	P	93	Very high	78.2	Confident	102 Å²	102	84.7 Å²	84.7	66%	0.662	43%	0.433	S	S	*	.	S	Bend	cis	-71.3	141.3	4.9	30.3	-35.8	0	0	0	112.7	R298	P296-R298 PolarHBondContact O-N 2.86Å
297	F	90.1	Very high	75.4	Confident	110 Å²	110	86.4 Å²	86.4	48%	0.482	44%	0.442	S	S	.	.			trans	-59.6	133.5	178.6	177.8	-109.1	0	0	0	111	H292 P299	H292-F297 HydrophobicContact CB-CD2 4.17Å; H292-F297 AromaticContact CD2-CD2 3.14Å; H292-F297 WeakPolarHBondContact CD2-CD2 3.16Å; H292-F297 AromaticContact CD2-CE2 3.52Å; H292-F297 AromaticContact CD2-CG 3.8Å; H292-F297 AromaticContact CE1-CD2 3.93Å; H292-F297 AromaticContact CE1-CG 3.78Å; H292-F297 AromaticContact CG-CD2 3.49Å; H292-F297 VanDerWaalsContact CG-CD2 3.49Å; H292-F297 AromaticContact CG-CG 3.93Å; H292-F297 AromaticContact ND1-CD2 3.97Å; H292-F297 AromaticContact ND1-CG 3.92Å; H292-F297 AromaticContact NE2-CD2 3.45Å; H292-F297 WeakPolarHBondContact NE2-CD2 3.21Å; H292-F297 AromaticContact NE2-CE2 3.73Å; H292-F297 AromaticContact NE2-CG 3.69Å; F297-P299 HydrophobicContact CD1-CG 4.46Å; F297-P299 HydrophobicContact CE1-CB 4.39Å; F297-P299 HydrophobicContact CE1-CG 3.96Å
298	R	84.9	Confident	72.6	Confident	205 Å²	205	87 Å²	87	77%	0.774	44%	0.444	S	S	*	.			trans	-123.4	117.5	173.8	-64.1	-174.3	-175.5	-174.7	2	108.4	P296 D300	P296-R298 PolarHBondContact O-N 2.86Å; R298-D300 PolarHBondContact O-N 3.19Å
299	P	71.7	Confident	69.7	Low	89 Å²	89	89.8 Å²	89.8	58%	0.578	46%	0.455	S	S	*	.			trans	-56.4	132.2	173.5	-20.1	29.8	0	0	0	110.1	F297 P301	F297-P299 HydrophobicContact CD1-CG 4.46Å; F297-P299 HydrophobicContact CE1-CB 4.39Å; F297-P299 HydrophobicContact CE1-CG 3.96Å; P299-P301 VanDerWaalsContact O-CD 3.26Å; P299-P301 WeakPolarHBondContact O-CD 3.01Å
300	D	64.8	Low	66.6	Low	55 Å²	55	94 Å²	94	29%	0.294	47%	0.474	S	S	.	.			trans	-70.2	116.7	170.8	-177.5	-7.4	0	0	0	108.1	R298 R302 Q303	R298-D300 PolarHBondContact O-N 3.19Å; D300-R302 PolarHBondContact O-N 3.32Å; D300-R302 WeakPolarHBondContact OD1-CB 3.46Å; D300-R302 PolarHBondContact OD1-N 2.84Å; D300-R302 IonicContact OD1-NE 2.79Å; D300-R302 PolarHBondContact OD1-NE 3.34Å; D300-R302 IonicContact OD2-NH2 3.9Å; D300-Q303 HydrophobicContact CB-CB 4.22Å; D300-Q303 HydrophobicContact CB-CG 4Å; D300-Q303 PolarHBondContact O-N 3.05Å
301	P	54.2	Low	63.7	Low	131 Å²	131	90.5 Å²	90.5	85%	0.851	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-11	180	24.4	-33.3	0	0	0	113.7	P299	P299-P301 VanDerWaalsContact O-CD 3.26Å; P299-P301 WeakPolarHBondContact O-CD 3.01Å
302	R	45.8	Very low	60.6	Low	205 Å²	205	94.7 Å²	94.7	77%	0.774	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-4.8	178	-60.1	173.4	-65	176.4	1.4	113.9	D300 P304	D300-R302 PolarHBondContact O-N 3.32Å; D300-R302 WeakPolarHBondContact OD1-CB 3.46Å; D300-R302 PolarHBondContact OD1-N 2.84Å; D300-R302 IonicContact OD1-NE 2.79Å; D300-R302 PolarHBondContact OD1-NE 3.34Å; D300-R302 IonicContact OD2-NH2 3.9Å; R302-P304 WeakPolarHBondContact O-CD 3.31Å
303	Q	47.2	Very low	57.6	Low	82 Å²	82	98.2 Å²	98.2	38%	0.383	52%	0.516	S	S	.	.	S	Bend	trans	-99.5	101.7	169.2	-66.1	-169.6	31.8	0	0	107.1	D300 E305	D300-Q303 HydrophobicContact CB-CB 4.22Å; D300-Q303 HydrophobicContact CB-CG 4Å; D300-Q303 PolarHBondContact O-N 3.05Å; Q303-E305 PolarHBondContact O-N 3.38Å
304	P	39.2	Very low	54.8	Low	70 Å²	70	99.7 Å²	99.7	46%	0.455	53%	0.527	S	S	.	.			trans	-58.7	136.6	174.8	22.9	-30.1	0	0	0	108.6	R302 E306 L307	R302-P304 WeakPolarHBondContact O-CD 3.31Å; P304-E306 HydrophobicContact CB-CB 4.07Å; P304-E306 HydrophobicContact CB-CG 4.11Å; P304-E306 PolarHBondContact O-N 3.29Å; P304-L307 PolarHBondContact O-N 3.4Å
305	E	45.7	Very low	51.8	Low	126 Å²	126	100.7 Å²	100.7	59%	0.589	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-53.8	-12.6	174	-63.5	-178.3	167.8	0	0	112.5	Q148 Q303 L307	Q148-E305 PolarHBondContact NE2-OE2 3.34Å; Q303-E305 PolarHBondContact O-N 3.38Å; E305-L307 PolarHBondContact O-N 2.98Å
306	E	40.5	Very low	48.9	Very low	120 Å²	120	106.3 Å²	106.3	56%	0.561	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-60.2	-17.5	174.2	-63.7	177.8	157.7	0	0	115	P304 C308 Q309	P304-E306 HydrophobicContact CB-CB 4.07Å; P304-E306 HydrophobicContact CB-CG 4.11Å; P304-E306 PolarHBondContact O-N 3.29Å; E306-C308 PolarHBondContact O-N 2.97Å; E306-Q309 PolarHBondContact O-N 2.69Å
307	L	38.5	Very low	45.8	Very low	37 Å²	37	109.6 Å²	109.6	19%	0.194	56%	0.557	C	S	.	*	G	3₁₀ helix	trans	-66.5	-20.5	-179.3	-91.3	157	0	0	0	114.2	K280 P304 E305	K280-L307 VanDerWaalsContact CA-CD2 3.47Å; K280-L307 HydrophobicContact CB-CD2 3.93Å; K280-L307 HydrophobicContact CD-CD1 4.5Å; K280-L307 HydrophobicContact CG-CD1 3.9Å; K280-L307 HydrophobicContact CG-CD2 3.29Å; K280-L307 HydrophobicContact CG-CG 4.24Å; P304-L307 PolarHBondContact O-N 3.4Å; E305-L307 PolarHBondContact O-N 2.98Å
308	C	38.6	Very low	42.9	Very low	28 Å²	28	110 Å²	110	19%	0.189	57%	0.571	C	S	.	*	G	3₁₀ helix	trans	-92.5	-1.7	171.8	-84.7	0	0	0	0	113.7	R142 W145 E306	R142-C308 PolarHBondContact NH2-O 3.44Å; W145-C308 HydrophobicContact CH2-CB 4.35Å; W145-C308 HydrophobicContact CZ2-CB 3.49Å; W145-C308 VanDerWaalsContact CZ2-CB 3.49Å; E306-C308 PolarHBondContact O-N 2.97Å
309	Q	37.7	Very low	40.4	Very low	72 Å²	72	108.5 Å²	108.5	34%	0.336	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.7	-11.4	-174	-60.6	-170.2	10.4	0	0	114.1	E306 G311	E306-Q309 PolarHBondContact O-N 2.69Å; Q309-G311 PolarHBondContact O-N 2.86Å
310	Q	34.5	Very low	38.4	Very low	135 Å²	135	107.2 Å²	107.2	63%	0.631	58%	0.58	S	S	*	*			trans	-75.1	95	-178.9	-63.2	-170.3	11.1	0	0	110.8
311	G	36.1	Very low	36.9	Very low	22 Å²	22	114 Å²	114	23%	0.227	61%	0.61	C	S	.	*	P	Polyproline II helix	trans	-55.8	158	153.2	0	0	0	0	0	109.9	Q309 S313	Q309-G311 PolarHBondContact O-N 2.86Å; G311-S313 PolarHBondContact O-N 2.95Å
312	P	32.5	Very low	36	Very low	106 Å²	106	116.9 Å²	116.9	69%	0.688	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-52.9	117.2	-178.4	21.6	-31.3	0	0	0	109.3	D314	P312-D314 PolarHBondContact O-N 2.96Å
313	S	35.3	Very low	35.3	Very low	102 Å²	102	110.1 Å²	110.1	71%	0.713	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-59.9	129	170.8	48.6	0	0	0	0	107.7	G311 S315	G311-S313 PolarHBondContact O-N 2.95Å; S313-S315 VanDerWaalsContact C-N 3.33Å; S313-S315 PolarHBondContact O-N 3.18Å
314	D	35.2	Very low	34.8	Very low	121 Å²	121	112.6 Å²	112.6	65%	0.647	63%	0.629	S	S	*	*			trans	-55.5	89.9	-177.5	-156.8	28.7	0	0	0	109.4	P312 R316	P312-D314 PolarHBondContact O-N 2.96Å; D314-R316 PolarHBondContact O-N 2.86Å; D314-R316 IonicContact OD2-CZ 3.62Å; D314-R316 IonicContact OD2-NE 2.94Å; D314-R316 PolarHBondContact OD2-NE 2.64Å; D314-R316 IonicContact OD2-NH2 3.38Å; D314-R316 PolarHBondContact OD2-NH2 2.81Å
315	S	30.3	Very low	34.6	Very low	110 Å²	110	121.2 Å²	121.2	77%	0.769	65%	0.652	S	S	*	*			trans	-74.6	76	171.1	43.7	0	0	0	0	108.1	S313 H317	S313-S315 VanDerWaalsContact C-N 3.33Å; S313-S315 PolarHBondContact O-N 3.18Å; S315-H317 PolarHBondContact O-N 3.34Å
316	R	31.3	Very low	34.1	Very low	205 Å²	205	126.8 Å²	126.8	77%	0.774	67%	0.668	S	S	*	*			trans	-65.5	86.9	162.1	-63.9	-174.4	-150.3	168.3	11.2	108.2	D314	D314-R316 PolarHBondContact O-N 2.86Å; D314-R316 IonicContact OD2-CZ 3.62Å; D314-R316 IonicContact OD2-NE 2.94Å; D314-R316 PolarHBondContact OD2-NE 2.64Å; D314-R316 IonicContact OD2-NH2 3.38Å; D314-R316 PolarHBondContact OD2-NH2 2.81Å
317	H	27.8	Very low	34.1	Very low	170 Å²	170	132.8 Å²	132.8	79%	0.787	69%	0.686	S	S	*	*			trans	-72.9	124.7	151.9	-92.5	-38.1	0	0	0	108.1	S315 L319	S315-H317 PolarHBondContact O-N 3.34Å; H317-L319 PolarHBondContact O-N 3.12Å
318	P	29.3	Very low	33.9	Very low	119 Å²	119	135.5 Å²	135.5	77%	0.773	71%	0.713	S	S	*	*			trans	-67.2	108.6	170.7	26.6	-28.5	0	0	0	107.4	G320	P318-G320 PolarHBondContact O-N 3.26Å
319	L	32.8	Very low	34.4	Very low	174 Å²	174	144 Å²	144	91%	0.911	77%	0.768	S	S	*	*			trans	-59.8	105.8	164.4	-80.5	164.8	0	0	0	107.2	H317 Q321	H317-L319 PolarHBondContact O-N 3.12Å; L319-Q321 PolarHBondContact O-N 2.99Å
320	G	29.1	Very low	34.2	Very low	62 Å²	62	147.6 Å²	147.6	64%	0.639	79%	0.789	S	S	*	*			trans	-54	135.9	173.5	0	0	0	0	0	110.5	P318 H322	P318-G320 PolarHBondContact O-N 3.26Å; G320-H322 PolarHBondContact O-N 2.79Å; G320-H322 VanDerWaalsContact O-N 3.15Å
321	Q	33.9	Very low	34.2	Very low	197 Å²	197	148.2 Å²	148.2	92%	0.921	80%	0.798	S	S	*	*			trans	-55.9	115.1	171.5	-65.3	177.4	7.1	0	0	109.7	L319	L319-Q321 PolarHBondContact O-N 2.99Å
322	H	34	Very low	34.1	Very low	192 Å²	192	155.2 Å²	155.2	89%	0.889	83%	0.829	S	S	*	*			trans	-114.2	121.5	158.7	-87	-43.8	0	0	0	109.2	G320	G320-H322 PolarHBondContact O-N 2.79Å; G320-H322 VanDerWaalsContact O-N 3.15Å
323	G	31.8	Very low	34.2	Very low	62 Å²	62	158.1 Å²	158.1	64%	0.639	84%	0.838	S	S	*	*			trans	-65.7	-178.7	-175	0	0	0	0	0	115.4	R325	G323-R325 PolarHBondContact O-N 3.26Å
324	P	36.1	Very low	34.2	Very low	135 Å²	135	161.6 Å²	161.6	88%	0.877	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-75.3	120.9	-158.8	30.4	-32.8	0	0	0	111.1
325	R	36.2	Very low	34.1	Very low	250 Å²	250	164.3 Å²	164.3	94%	0.943	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-90.7	129.9	165.6	-76.5	-168.1	-178.3	-156.5	2.4	110.5	G323	G323-R325 PolarHBondContact O-N 3.26Å
326	R	33.8	Very low	34.4	Very low	244 Å²	244	168.2 Å²	168.2	92%	0.921	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-59.4	144.2	-172.7	-64.6	170.9	173.8	-157	-2.9	112.7
327	R	41.2	Very low	34.6	Very low	246 Å²	246	165.4 Å²	165.4	93%	0.928	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-68.2	140.5	155.5	-74	-176.8	175.4	-164.6	-1.5	109.9
328	A	34	Very low	35.2	Very low	94 Å²	94	165 Å²	165	78%	0.777	88%	0.879	S	S	*	*			trans	178.2	161.9	145.4	0	0	0	0	0	110.1
329	P	49.7	Very low	35.7	Very low	205 Å²	205	169.2 Å²	169.2	100%	1.331	89%	0.889	S	S	*	*			cis	-95	0	-24.4	6.2	15.3	0	0	0	112.6

Retrieved 329 of 329 residues in 100.9 ms (Link to these results)

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