A0A060Y0B7_ONCMY Loading...

Chromo domain-containing protein

AlphaFold DB (B9ELS6), UniProt , Accession A0A060Y0B7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 177 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.5	Very low	48.1	Very low	243 Å²	243	167.2 Å²	167.2	100%	1.197	88%	0.875	S	S	*	*				0	116.3	0	-72	66.9	174.7	0	0	109.1
2	G	41.7	Very low	48.5	Very low	84 Å²	84	168.4 Å²	168.4	87%	0.866	87%	0.873	S	S	*	*			trans	-94.5	129.4	178.6	0	0	0	0	0	112.2
3	K	55.5	Low	48.9	Very low	217 Å²	217	165.6 Å²	165.6	94%	0.943	87%	0.867	S	S	*	*			trans	-76	132.3	168.7	-72	176	173.8	177.3	0	109.9
4	K	50.5	Low	49.2	Very low	193 Å²	193	165.2 Å²	165.2	84%	0.839	87%	0.865	S	S	*	*			trans	-154.8	102.5	144.7	-152.6	161	-177.2	175.7	0	111.4
5	Q	53.6	Low	49.7	Very low	197 Å²	197	166.1 Å²	166.1	92%	0.921	86%	0.863	S	S	*	*			trans	-75.1	127.3	162.6	-66.8	172.3	-0.3	0	0	107.1
6	N	38.7	Very low	50.2	Low	150 Å²	150	161.6 Å²	161.6	80%	0.802	86%	0.857	S	S	*	*			trans	-103.7	111.4	175.6	-163.7	65.8	0	0	0	109.3
7	G	48.2	Very low	50.9	Low	57 Å²	57	161.7 Å²	161.7	59%	0.588	85%	0.852	S	S	*	*			trans	-98.2	177.6	175.4	0	0	0	0	0	112.9
8	K	50.7	Low	51.5	Low	223 Å²	223	157.9 Å²	157.9	97%	0.97	84%	0.839	S	S	*	*			trans	77.2	125.2	179	-68.8	-173.4	169.7	-174.6	0	116.8
9	G	41.9	Very low	52.1	Low	73 Å²	73	155.8 Å²	155.8	75%	0.753	84%	0.835	S	S	*	*			trans	167.5	32.9	177.7	0	0	0	0	0	112	K11	G9-K11 PolarHBondContact O-N 2.62Å
10	K	50	Low	52.8	Low	207 Å²	207	155.1 Å²	155.1	90%	0.9	83%	0.826	S	S	*	*			trans	-66.5	106.7	167.1	-99.3	-167.9	171.1	-169.5	0	106.1	E12	K10-E12 PolarHBondContact O-N 3.32Å
11	K	54.4	Low	53.7	Low	195 Å²	195	157 Å²	157	85%	0.848	83%	0.83	S	S	*	*			trans	-64.6	123.8	161.8	-79.3	-174	171.9	-174.7	0	107.1	G9 V13	G9-K11 PolarHBondContact O-N 2.62Å; K11-V13 PolarHBondContact O-N 2.73Å
12	E	52.6	Low	55.3	Low	182 Å²	182	150.6 Å²	150.6	85%	0.85	79%	0.793	S	S	*	*			trans	-61.7	123.8	158.7	-77.6	162.2	100.5	0	0	107.2	K10 L14	K10-E12 PolarHBondContact O-N 3.32Å; E12-L14 PolarHBondContact O-N 3.47Å
13	V	53.9	Low	57.2	Low	132 Å²	132	151.2 Å²	151.2	80%	0.8	78%	0.78	S	S	*	*			trans	-78.6	110.2	165.5	178.7	0	0	0	0	104.1	K11 E15	K11-V13 PolarHBondContact O-N 2.73Å; V13-E15 PolarHBondContact O-N 2.78Å; V13-E15 VanDerWaalsContact O-N 3.14Å
14	L	53.4	Low	58.4	Low	160 Å²	160	142 Å²	142	84%	0.838	74%	0.742	S	S	*	*			trans	-61.5	118.1	164.3	-102.9	85.9	0	0	0	106.5	E12 A16	E12-L14 PolarHBondContact O-N 3.47Å; L14-A16 PolarHBondContact O-N 3.47Å
15	E	55.9	Low	59.9	Low	179 Å²	179	137.6 Å²	137.6	84%	0.836	72%	0.724	S	S	*	*			trans	-66.6	103.5	170.6	-152	156.3	148.1	0	0	106.2	V13 E17	V13-E15 PolarHBondContact O-N 2.78Å; V13-E15 VanDerWaalsContact O-N 3.14Å; E15-E17 PolarHBondContact O-N 3.42Å
16	A	58.6	Low	61.2	Low	93 Å²	93	134.1 Å²	134.1	77%	0.769	71%	0.706	S	S	*	*			trans	-72.7	110.4	172.5	0	0	0	0	0	106.8	L14	L14-A16 PolarHBondContact O-N 3.47Å
17	E	61.8	Low	63.3	Low	164 Å²	164	127.3 Å²	127.3	77%	0.766	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-47.1	139.5	168.8	-71.9	-77.2	136.7	0	0	109.2	E15	E15-E17 PolarHBondContact O-N 3.42Å
18	P	61.3	Low	64.8	Low	94 Å²	94	128 Å²	128	61%	0.61	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-60.1	145.2	-179.5	27	-34.5	0	0	0	110.2	E20	P18-E20 PolarHBondContact O-N 2.6Å; P18-E20 VanDerWaalsContact O-N 3.15Å
19	P	62.2	Low	66	Low	117 Å²	117	121 Å²	121	76%	0.76	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-59.7	122	175.7	25.8	-33.3	0	0	0	109.5	E21	P19-E21 PolarHBondContact O-N 3.43Å
20	E	66.5	Low	67.9	Low	141 Å²	141	120.5 Å²	120.5	66%	0.659	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-76.6	120	177.4	-69.6	-177.6	138.9	0	0	109.8	P18 Y22	P18-E20 PolarHBondContact O-N 2.6Å; P18-E20 VanDerWaalsContact O-N 3.15Å; E20-Y22 HydrophobicContact CB-CD2 4.16Å; E20-Y22 HydrophobicContact CB-CE2 3.44Å; E20-Y22 VanDerWaalsContact CB-CE2 3.44Å; E20-Y22 WeakPolarHBondContact O-CD2 3.47Å; E20-Y22 PolarHBondContact OE2-OH 3.32Å
21	E	72.9	Confident	69.3	Low	196 Å²	196	114.7 Å²	114.7	92%	0.916	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-81.1	117	177.5	-67.7	174.7	-165	0	0	110.8	P19	P19-E21 PolarHBondContact O-N 3.43Å
22	Y	77.8	Confident	70.5	Confident	108 Å²	108	111.3 Å²	111.3	42%	0.424	57%	0.573	S	S	.	*			trans	-108.2	137.2	179.5	-70.8	-85.7	0	0	0	111.9	E20 V24 W43 F46	E20-Y22 HydrophobicContact CB-CD2 4.16Å; E20-Y22 HydrophobicContact CB-CE2 3.44Å; E20-Y22 VanDerWaalsContact CB-CE2 3.44Å; E20-Y22 WeakPolarHBondContact O-CD2 3.47Å; E20-Y22 PolarHBondContact OE2-OH 3.32Å; Y22-V24 PolarHBondContact O-N 3.37Å; Y22-W43 WeakPolarHBondContact O-CZ3 3.43Å; Y22-F46 AromaticContact CD1-CE2 3.86Å; Y22-F46 HydrophobicContact CD1-CE2 3.86Å; Y22-F46 HydrophobicContact CD1-CZ 4.05Å; Y22-F46 HydrophobicContact CE1-CE2 4.07Å; Y22-F46 AromaticContact CE1-CZ 3.76Å; Y22-F46 HydrophobicContact CE1-CZ 3.76Å
23	V	80.9	Confident	71.5	Confident	97 Å²	97	103.9 Å²	103.9	59%	0.588	54%	0.539	S	S	*	.			trans	-79.6	118.7	-179.8	-179.7	0	0	0	0	110.6	K44	V23-K44 HydrophobicContact CB-CB 4.15Å; V23-K44 HydrophobicContact CB-CD 4.43Å; V23-K44 HydrophobicContact CG1-CB 4.02Å; V23-K44 HydrophobicContact CG1-CD 3.72Å; V23-K44 VanDerWaalsContact O-CB 3.28Å; V23-K44 WeakPolarHBondContact O-CB 3.34Å; V23-K44 PolarHBondContact O-N 3.48Å
24	V	81	Confident	72.3	Confident	24 Å²	24	105.3 Å²	105.3	15%	0.145	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129.2	172.1	-176.5	0	0	0	0	110.1	Y22 L41 W43 L64	Y22-V24 PolarHBondContact O-N 3.37Å; V24-L41 HydrophobicContact CG1-CB 4.5Å; V24-L41 HydrophobicContact CG1-CD2 4.04Å; V24-L41 HydrophobicContact CG2-CD1 3.94Å; V24-W43 HydrophobicContact CG2-CE3 4.07Å; V24-W43 HydrophobicContact CG2-CH2 4.39Å; V24-W43 HydrophobicContact CG2-CZ3 3.6Å; V24-L64 HydrophobicContact CB-CD1 4.07Å; V24-L64 HydrophobicContact CG1-CD1 3.71Å
25	E	82.3	Confident	73.2	Confident	100 Å²	100	101.1 Å²	101.1	47%	0.467	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-43.3	172.3	-167.5	178.9	110.6	0	0	111.2	K42 K44	E25-K42 WeakPolarHBondContact CA-O 3.45Å; E25-K42 HydrophobicContact CB-CB 4.32Å; E25-K42 HydrophobicContact CB-CG 3.89Å; E25-K42 VanDerWaalsContact CB-O 3.27Å; E25-K42 WeakPolarHBondContact CB-O 3.28Å; E25-K42 HydrophobicContact CG-CG 4.32Å; E25-K42 PolarHBondContact N-O 2.86Å; E25-K44 HydrophobicContact CB-CB 3.95Å; E25-K44 WeakPolarHBondContact OE2-CA 3.29Å
26	K	79.8	Confident	73.8	Confident	124 Å²	124	97.9 Å²	97.9	54%	0.539	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	140.4	-177.6	-166.2	-176.8	173.6	-173.8	0	112.2	M28 K42	K26-M28 HydrophobicContact CD-SD 4.25Å; K26-M28 PolarHBondContact O-N 3Å; K26-K42 HydrophobicContact CB-CB 4.05Å; K26-K42 PolarHBondContact N-O 2.8Å; K26-K42 PolarHBondContact O-N 3.47Å
27	V	82.4	Confident	74.7	Confident	7 Å²	7	95 Å²	95	4%	0.042	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	118.3	162.4	179.7	0	0	0	0	108.7	F39 L41 L64 I65 F68	V27-F39 HydrophobicContact CG1-CB 4.38Å; V27-F39 HydrophobicContact CG1-CD1 3.69Å; V27-F39 HydrophobicContact CG1-CE1 4.47Å; V27-F39 HydrophobicContact CG1-CG 4.45Å; V27-L41 HydrophobicContact CB-CD2 4.38Å; V27-L41 HydrophobicContact CG2-CD2 3.87Å; V27-L64 HydrophobicContact CG2-CB 4Å; V27-I65 HydrophobicContact CG2-CG1 4.1Å; V27-F68 HydrophobicContact CB-CB 4.15Å; V27-F68 HydrophobicContact CB-CD2 4.27Å; V27-F68 HydrophobicContact CB-CG 4.29Å; V27-F68 HydrophobicContact CG1-CB 3.99Å; V27-F68 HydrophobicContact CG1-CD1 4.13Å; V27-F68 HydrophobicContact CG1-CD2 3.74Å; V27-F68 HydrophobicContact CG1-CE2 4.26Å; V27-F68 HydrophobicContact CG1-CG 3.67Å
28	M	80.2	Confident	75.8	Confident	73 Å²	73	88.9 Å²	88.9	36%	0.36	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-39	-177.7	-66.8	-72.2	-72.4	0	0	111.9	K26 F40 K42	K26-M28 HydrophobicContact CD-SD 4.25Å; K26-M28 PolarHBondContact O-N 3Å; M28-F40 WeakPolarHBondContact CA-O 3.43Å; M28-F40 HydrophobicContact CB-CB 4.43Å; M28-F40 HydrophobicContact CB-CD1 3.67Å; M28-F40 HydrophobicContact CB-CE1 4.43Å; M28-F40 HydrophobicContact CB-CG 4.42Å; M28-F40 WeakPolarHBondContact CB-O 3.27Å; M28-F40 HydrophobicContact CG-CD1 4.43Å; M28-F40 PolarHBondContact N-O 3.43Å; M28-K42 HydrophobicContact CG-CB 3.95Å; M28-K42 HydrophobicContact SD-CB 4.24Å
29	D	76.8	Confident	76.6	Confident	76 Å²	76	84.5 Å²	84.5	41%	0.406	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	169.1	-177.9	-152.4	-9.7	0	0	0	111.5	F39 F40 W53	D29-F39 CarbonylContact O-C 3.58Å; D29-F39 WeakPolarHBondContact O-CA 3.5Å; D29-F40 HydrophobicContact CB-CB 3.82Å; D29-F40 PolarHBondContact N-O 3.15Å; D29-F40 PolarHBondContact O-N 2.66Å; D29-W53 HydrophobicContact CB-CH2 3.87Å; D29-W53 HydrophobicContact CB-CZ3 4.44Å
30	Q	82	Confident	77.7	Confident	62 Å²	62	81.4 Å²	81.4	29%	0.29	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	137.9	175.6	-175	-172.3	36.5	0	0	110.5	V37 E38 F39 F68 L69	Q30-V37 HydrophobicContact CG-CG1 3.87Å; Q30-E38 WeakPolarHBondContact CA-O 3.38Å; Q30-F39 HydrophobicContact CB-CD1 3.81Å; Q30-F39 HydrophobicContact CB-CE1 3.9Å; Q30-F39 HydrophobicContact CG-CD1 3.77Å; Q30-F39 HydrophobicContact CG-CE1 3.54Å; Q30-F39 HydrophobicContact CG-CZ 4.1Å; Q30-F39 VanDerWaalsContact NE2-CE1 3.33Å; Q30-F68 HydrophobicContact CB-CD1 4.36Å; Q30-F68 HydrophobicContact CB-CE1 3.56Å; Q30-F68 HydrophobicContact CB-CZ 4.17Å; Q30-L69 VanDerWaalsContact OE1-CD2 3.28Å
31	R	78.9	Confident	78.5	Confident	85 Å²	85	74.7 Å²	74.7	32%	0.321	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	166.8	172.5	73.2	-175.6	-175.4	-164.6	1.2	111.5	V33 E38 W53	R31-V33 HydrophobicContact CG-CG2 3.99Å; R31-E38 HydrophobicContact CG-CB 4.01Å; R31-E38 IonicContact CZ-OE2 2.73Å; R31-E38 PolarHBondContact N-O 2.86Å; R31-E38 IonicContact NE-OE2 2.76Å; R31-E38 PolarHBondContact NE-OE2 3.26Å; R31-E38 IonicContact NH2-OE2 3.12Å; R31-E38 PolarHBondContact NH2-OE2 3Å; R31-E38 PolarHBondContact O-N 2.74Å; R31-W53 HydrophobicContact CB-CE3 4.47Å; R31-W53 HydrophobicContact CB-CH2 4.01Å; R31-W53 HydrophobicContact CB-CZ3 3.75Å; R31-W53 HydrophobicContact CG-CD2 4.38Å; R31-W53 HydrophobicContact CG-CE3 3.59Å; R31-W53 HydrophobicContact CG-CH2 3.94Å; R31-W53 HydrophobicContact CG-CZ3 3.36Å; R31-W53 VanDerWaalsContact CZ-CD2 3.4Å; R31-W53 VanDerWaalsContact NH1-CE2 3.33Å
32	I	78.5	Confident	79.1	Confident	124 Å²	124	66.2 Å²	66.2	64%	0.636	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.3	117.9	172.2	-56.4	177.9	0	0	0	108	K36 V37	I32-K36 CarbonylContact C-O 3.53Å; I32-K36 VanDerWaalsContact CA-O 3.31Å; I32-K36 WeakPolarHBondContact CA-O 3.35Å; I32-V37 HydrophobicContact CG1-CG2 4.4Å
33	V	73.4	Confident	79.5	Confident	25 Å²	25	62.2 Å²	62.2	15%	0.152	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.3	178.7	175.7	0	0	0	0	108.4	R31 G35 K36	R31-V33 HydrophobicContact CG-CG2 3.99Å; V33-G35 PolarHBondContact O-N 3.29Å; V33-K36 PolarHBondContact N-O 2.88Å; V33-K36 PolarHBondContact O-N 2.78Å
34	N	71.3	Confident	79.2	Confident	162 Å²	162	64 Å²	64	87%	0.866	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	30.8	-179.8	-60.5	-26.6	0	0	0	114.6	K36	N34-K36 VanDerWaalsContact C-N 3.27Å; N34-K36 PolarHBondContact O-N 3.4Å
35	G	72.6	Confident	79	Confident	72 Å²	72	66.6 Å²	66.6	74%	0.742	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	1.3	-177.3	0	0	0	0	0	115.2	V33	V33-G35 PolarHBondContact O-N 3.29Å
36	K	69.3	Low	78.6	Confident	112 Å²	112	66.5 Å²	66.5	49%	0.487	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	142.9	168.8	-73.1	-177.1	166.8	-112.6	0	110.4	I32 V33 N34 D57	I32-K36 CarbonylContact C-O 3.53Å; I32-K36 VanDerWaalsContact CA-O 3.31Å; I32-K36 WeakPolarHBondContact CA-O 3.35Å; V33-K36 PolarHBondContact N-O 2.88Å; V33-K36 PolarHBondContact O-N 2.78Å; N34-K36 VanDerWaalsContact C-N 3.27Å; N34-K36 PolarHBondContact O-N 3.4Å; K36-D57 IonicContact NZ-OD2 2.61Å; K36-D57 PolarHBondContact NZ-OD2 3.23Å
37	V	76.9	Confident	78.6	Confident	31 Å²	31	64.7 Å²	64.7	19%	0.188	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	132.3	171.3	178.3	0	0	0	0	108.3	Q30 I32 F39 P55 E56	Q30-V37 HydrophobicContact CG-CG1 3.87Å; I32-V37 HydrophobicContact CG1-CG2 4.4Å; V37-F39 HydrophobicContact CG1-CD2 4.07Å; V37-F39 HydrophobicContact CG1-CE1 4.45Å; V37-F39 HydrophobicContact CG1-CE2 3.45Å; V37-F39 VanDerWaalsContact CG1-CE2 3.45Å; V37-F39 HydrophobicContact CG1-CZ 3.69Å; V37-P55 CarbonylContact O-C 3.5Å; V37-P55 WeakPolarHBondContact O-CA 3.35Å; V37-E56 HydrophobicContact CB-CB 4.11Å; V37-E56 WeakPolarHBondContact CB-OE2 3.34Å; V37-E56 HydrophobicContact CG1-CB 4.4Å; V37-E56 PolarHBondContact O-N 3.14Å
38	E	84.4	Confident	78	Confident	37 Å²	37	71 Å²	71	17%	0.173	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.8	171.9	-65.4	176.6	168.3	0	0	109.3	Q30 R31 W53 E54 P55	Q30-E38 WeakPolarHBondContact CA-O 3.38Å; R31-E38 HydrophobicContact CG-CB 4.01Å; R31-E38 IonicContact CZ-OE2 2.73Å; R31-E38 PolarHBondContact N-O 2.86Å; R31-E38 IonicContact NE-OE2 2.76Å; R31-E38 PolarHBondContact NE-OE2 3.26Å; R31-E38 IonicContact NH2-OE2 3.12Å; R31-E38 PolarHBondContact NH2-OE2 3Å; R31-E38 PolarHBondContact O-N 2.74Å; E38-W53 HydrophobicContact CB-CE3 4.18Å; E38-E54 CarbonylContact C-O 3.59Å; E38-E54 VanDerWaalsContact CA-O 3.25Å; E38-E54 WeakPolarHBondContact CA-O 3.46Å; E38-P55 HydrophobicContact CG-CB 4.46Å
39	F	78.9	Confident	77.7	Confident	1 Å²	1	71.9 Å²	71.9	0%	0.004	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.1	177.5	-65.3	-88.2	0	0	0	110.2	V27 D29 Q30 V37 L41 W53 E54 E56 L59 I65	V27-F39 HydrophobicContact CG1-CB 4.38Å; V27-F39 HydrophobicContact CG1-CD1 3.69Å; V27-F39 HydrophobicContact CG1-CE1 4.47Å; V27-F39 HydrophobicContact CG1-CG 4.45Å; D29-F39 CarbonylContact O-C 3.58Å; D29-F39 WeakPolarHBondContact O-CA 3.5Å; Q30-F39 HydrophobicContact CB-CD1 3.81Å; Q30-F39 HydrophobicContact CB-CE1 3.9Å; Q30-F39 HydrophobicContact CG-CD1 3.77Å; Q30-F39 HydrophobicContact CG-CE1 3.54Å; Q30-F39 HydrophobicContact CG-CZ 4.1Å; Q30-F39 VanDerWaalsContact NE2-CE1 3.33Å; V37-F39 HydrophobicContact CG1-CD2 4.07Å; V37-F39 HydrophobicContact CG1-CE1 4.45Å; V37-F39 HydrophobicContact CG1-CE2 3.45Å; V37-F39 VanDerWaalsContact CG1-CE2 3.45Å; V37-F39 HydrophobicContact CG1-CZ 3.69Å; F39-L41 HydrophobicContact CB-CD2 3.84Å; F39-L41 HydrophobicContact CB-CG 4.37Å; F39-W53 WeakPolarHBondContact O-CA 2.93Å; F39-E54 PolarHBondContact N-O 3.16Å; F39-E54 PolarHBondContact O-N 3.28Å; F39-E56 HydrophobicContact CE2-CB 4.04Å; F39-E56 HydrophobicContact CE2-CG 4.17Å; F39-L59 HydrophobicContact CB-CD1 3.87Å; F39-L59 HydrophobicContact CD2-CD1 3.67Å; F39-L59 HydrophobicContact CG-CD1 4.12Å; F39-I65 HydrophobicContact CD2-CD1 4.43Å; F39-I65 HydrophobicContact CE1-CG1 4.3Å; F39-I65 HydrophobicContact CE1-CG2 3.88Å; F39-I65 HydrophobicContact CE2-CD1 4.13Å; F39-I65 HydrophobicContact CE2-CG1 4.29Å; F39-I65 HydrophobicContact CE2-CG2 4.18Å; F39-I65 HydrophobicContact CZ-CB 4.4Å; F39-I65 HydrophobicContact CZ-CD1 4.42Å; F39-I65 HydrophobicContact CZ-CG1 4.15Å; F39-I65 HydrophobicContact CZ-CG2 3.46Å; F39-I65 VanDerWaalsContact CZ-CG2 3.46Å
40	F	84.9	Confident	77.4	Confident	53 Å²	53	71.8 Å²	71.8	23%	0.232	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	123	171.4	-169.5	-127.6	0	0	0	108.8	M28 D29 N51 T52 W53	M28-F40 WeakPolarHBondContact CA-O 3.43Å; M28-F40 HydrophobicContact CB-CB 4.43Å; M28-F40 HydrophobicContact CB-CD1 3.67Å; M28-F40 HydrophobicContact CB-CE1 4.43Å; M28-F40 HydrophobicContact CB-CG 4.42Å; M28-F40 WeakPolarHBondContact CB-O 3.27Å; M28-F40 HydrophobicContact CG-CD1 4.43Å; M28-F40 PolarHBondContact N-O 3.43Å; D29-F40 HydrophobicContact CB-CB 3.82Å; D29-F40 PolarHBondContact N-O 3.15Å; D29-F40 PolarHBondContact O-N 2.66Å; F40-N51 HydrophobicContact CD2-CB 4.36Å; F40-N51 HydrophobicContact CE1-CB 3.96Å; F40-N51 HydrophobicContact CE2-CB 3.58Å; F40-N51 WeakPolarHBondContact CE2-O 3.37Å; F40-N51 HydrophobicContact CZ-CB 3.34Å; F40-T52 WeakPolarHBondContact CA-O 3.49Å; F40-T52 VanDerWaalsContact CD2-O 3.32Å; F40-T52 WeakPolarHBondContact CD2-O 3.39Å; F40-W53 HydrophobicContact CB-CD2 3.83Å; F40-W53 HydrophobicContact CB-CE3 3.78Å; F40-W53 HydrophobicContact CB-CH2 3.74Å; F40-W53 HydrophobicContact CB-CZ2 3.78Å; F40-W53 HydrophobicContact CB-CZ3 3.71Å; F40-W53 AromaticContact CD2-CD1 3.7Å; F40-W53 AromaticContact CD2-CD2 3.98Å; F40-W53 HydrophobicContact CD2-CD2 3.98Å; F40-W53 AromaticContact CD2-CE2 3.71Å; F40-W53 HydrophobicContact CD2-CG 4.02Å; F40-W53 HydrophobicContact CD2-CZ2 4.31Å; F40-W53 AromaticContact CD2-NE1 3.48Å; F40-W53 AromaticContact CE2-NE1 3.95Å; F40-W53 HydrophobicContact CG-CD2 4.3Å; F40-W53 AromaticContact CG-CE2 3.95Å; F40-W53 HydrophobicContact CG-CZ2 4.11Å
41	L	83.5	Confident	77.3	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.6	-167.1	-58.3	178.5	0	0	0	112.5	V24 V27 F39 W43 N51 T52 E54 L59	V24-L41 HydrophobicContact CG1-CB 4.5Å; V24-L41 HydrophobicContact CG1-CD2 4.04Å; V24-L41 HydrophobicContact CG2-CD1 3.94Å; V27-L41 HydrophobicContact CB-CD2 4.38Å; V27-L41 HydrophobicContact CG2-CD2 3.87Å; F39-L41 HydrophobicContact CB-CD2 3.84Å; F39-L41 HydrophobicContact CB-CG 4.37Å; L41-W43 HydrophobicContact CB-CZ2 4.43Å; L41-W43 HydrophobicContact CD1-CH2 3.86Å; L41-W43 HydrophobicContact CD1-CZ2 4.1Å; L41-W43 HydrophobicContact CD1-CZ3 4.33Å; L41-N51 WeakPolarHBondContact O-CA 3.21Å; L41-N51 WeakPolarHBondContact O-CB 3.44Å; L41-N51 PolarHBondContact O-OD1 3.07Å; L41-T52 PolarHBondContact N-O 3.46Å; L41-E54 HydrophobicContact CD1-CB 3.9Å; L41-E54 HydrophobicContact CD1-CG 3.8Å; L41-L59 HydrophobicContact CD1-CD1 3.84Å; L41-L59 HydrophobicContact CD1-CD2 3.28Å; L41-L59 HydrophobicContact CD1-CG 4.2Å; L41-L59 HydrophobicContact CD2-CD1 4.39Å
42	K	85.6	Confident	77.4	Confident	17 Å²	17	68.2 Å²	68.2	7%	0.074	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114.5	160.8	-179.2	79.7	-161	84.3	0	107.9	E25 K26 M28 F46 T47 E48 N51	E25-K42 WeakPolarHBondContact CA-O 3.45Å; E25-K42 HydrophobicContact CB-CB 4.32Å; E25-K42 HydrophobicContact CB-CG 3.89Å; E25-K42 VanDerWaalsContact CB-O 3.27Å; E25-K42 WeakPolarHBondContact CB-O 3.28Å; E25-K42 HydrophobicContact CG-CG 4.32Å; E25-K42 PolarHBondContact N-O 2.86Å; K26-K42 HydrophobicContact CB-CB 4.05Å; K26-K42 PolarHBondContact N-O 2.8Å; K26-K42 PolarHBondContact O-N 3.47Å; M28-K42 HydrophobicContact CG-CB 3.95Å; M28-K42 HydrophobicContact SD-CB 4.24Å; K42-F46 PolarHBondContact NZ-O 3.22Å; K42-T47 VanDerWaalsContact NZ-C 3.3Å; K42-T47 PolarHBondContact NZ-O 3.21Å; K42-E48 HydrophobicContact CD-CG 3.91Å; K42-N51 WeakPolarHBondContact CA-OD1 3.5Å
43	W	85.9	Confident	77.8	Confident	24 Å²	24	65.9 Å²	65.9	9%	0.091	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	139.7	172.7	-58	113.2	0	0	0	111.6	Y22 V24 L41 F46 D50 T52 E54	Y22-W43 WeakPolarHBondContact O-CZ3 3.43Å; V24-W43 HydrophobicContact CG2-CE3 4.07Å; V24-W43 HydrophobicContact CG2-CH2 4.39Å; V24-W43 HydrophobicContact CG2-CZ3 3.6Å; L41-W43 HydrophobicContact CB-CZ2 4.43Å; L41-W43 HydrophobicContact CD1-CH2 3.86Å; L41-W43 HydrophobicContact CD1-CZ2 4.1Å; L41-W43 HydrophobicContact CD1-CZ3 4.33Å; W43-F46 HydrophobicContact CB-CB 4.03Å; W43-F46 HydrophobicContact CB-CD2 3.83Å; W43-F46 HydrophobicContact CB-CG 4.21Å; W43-F46 PolarHBondContact O-N 3.49Å; W43-D50 VanDerWaalsContact CD1-O 3.23Å; W43-T52 WeakPolarHBondContact CZ2-OG1 3.29Å; W43-T52 PolarHBondContact NE1-OG1 3.38Å; W43-E54 HydrophobicContact CH2-CG 3.88Å; W43-E54 HydrophobicContact CZ2-CG 3.55Å
44	K	75.2	Confident	78.4	Confident	135 Å²	135	66.6 Å²	66.6	59%	0.587	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	123.7	-176.2	-172.2	179.2	-178.2	176	0	111.3	V23 E25 F46	V23-K44 HydrophobicContact CB-CB 4.15Å; V23-K44 HydrophobicContact CB-CD 4.43Å; V23-K44 HydrophobicContact CG1-CB 4.02Å; V23-K44 HydrophobicContact CG1-CD 3.72Å; V23-K44 VanDerWaalsContact O-CB 3.28Å; V23-K44 WeakPolarHBondContact O-CB 3.34Å; V23-K44 PolarHBondContact O-N 3.48Å; E25-K44 HydrophobicContact CB-CB 3.95Å; E25-K44 WeakPolarHBondContact OE2-CA 3.29Å; K44-F46 VanDerWaalsContact C-N 3.26Å; K44-F46 PolarHBondContact O-N 3.25Å
45	G	75.9	Confident	78.8	Confident	78 Å²	78	60.6 Å²	60.6	80%	0.804	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-3.7	-178.7	0	0	0	0	0	115
46	F	75.2	Confident	79.2	Confident	99 Å²	99	62.2 Å²	62.2	43%	0.434	34%	0.335	S	S	.	.	S	Bend	trans	-98.2	172	170.4	-67.2	-91.2	0	0	0	110.6	Y22 K42 W43 K44 D50	Y22-F46 AromaticContact CD1-CE2 3.86Å; Y22-F46 HydrophobicContact CD1-CE2 3.86Å; Y22-F46 HydrophobicContact CD1-CZ 4.05Å; Y22-F46 HydrophobicContact CE1-CE2 4.07Å; Y22-F46 AromaticContact CE1-CZ 3.76Å; Y22-F46 HydrophobicContact CE1-CZ 3.76Å; K42-F46 PolarHBondContact NZ-O 3.22Å; W43-F46 HydrophobicContact CB-CB 4.03Å; W43-F46 HydrophobicContact CB-CD2 3.83Å; W43-F46 HydrophobicContact CB-CG 4.21Å; W43-F46 PolarHBondContact O-N 3.49Å; K44-F46 VanDerWaalsContact C-N 3.26Å; K44-F46 PolarHBondContact O-N 3.25Å; F46-D50 HydrophobicContact CB-CB 3.95Å; F46-D50 HydrophobicContact CD1-CB 4.43Å
47	T	78.3	Confident	79.6	Confident	85 Å²	85	62.9 Å²	62.9	52%	0.521	34%	0.344	S	S	.	.			trans	-84.8	173.7	176.8	74.1	0	0	0	0	111.3	K42 A49 D50 N51	K42-T47 VanDerWaalsContact NZ-C 3.3Å; K42-T47 PolarHBondContact NZ-O 3.21Å; T47-A49 PolarHBondContact O-N 3.14Å; T47-A49 PolarHBondContact OG1-N 3.11Å; T47-D50 WeakPolarHBondContact CA-OD2 3.22Å; T47-D50 WeakPolarHBondContact CB-OD2 3.12Å; T47-D50 PolarHBondContact N-OD2 2.95Å; T47-D50 PolarHBondContact O-N 2.87Å; T47-D50 PolarHBondContact OG1-OD2 3.18Å; T47-N51 PolarHBondContact O-OD1 2.9Å
48	E	70.1	Confident	79.7	Confident	139 Å²	139	65.9 Å²	65.9	65%	0.65	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-73	-13.5	174	-63.2	175.7	123.3	0	0	112.7	K42 D50 N51	K42-E48 HydrophobicContact CD-CG 3.91Å; E48-D50 VanDerWaalsContact C-N 3.29Å; E48-N51 WeakPolarHBondContact CA-OD1 3.4Å; E48-N51 VanDerWaalsContact O-CG 3.31Å
49	A	73.1	Confident	79.5	Confident	92 Å²	92	65 Å²	65	76%	0.76	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-76.7	-19.1	174.9	0	0	0	0	0	112.7	T47 N51	T47-A49 PolarHBondContact O-N 3.14Å; T47-A49 PolarHBondContact OG1-N 3.11Å; A49-N51 VanDerWaalsContact C-N 3.34Å
50	D	71.3	Confident	79.3	Confident	74 Å²	74	73 Å²	73	40%	0.396	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-91	0.1	179.4	-49.2	-65.2	0	0	0	112.1	W43 F46 T47 E48 T52	W43-D50 VanDerWaalsContact CD1-O 3.23Å; F46-D50 HydrophobicContact CB-CB 3.95Å; F46-D50 HydrophobicContact CD1-CB 4.43Å; T47-D50 WeakPolarHBondContact CA-OD2 3.22Å; T47-D50 WeakPolarHBondContact CB-OD2 3.12Å; T47-D50 PolarHBondContact N-OD2 2.95Å; T47-D50 PolarHBondContact O-N 2.87Å; T47-D50 PolarHBondContact OG1-OD2 3.18Å; E48-D50 VanDerWaalsContact C-N 3.29Å; D50-T52 PolarHBondContact O-N 2.9Å
51	N	79.9	Confident	79	Confident	18 Å²	18	71.5 Å²	71.5	10%	0.096	39%	0.394	C	S	.	.			trans	-63.4	129.8	178.7	-69.2	10.5	0	0	0	110.8	F40 L41 K42 T47 E48 A49	F40-N51 HydrophobicContact CD2-CB 4.36Å; F40-N51 HydrophobicContact CE1-CB 3.96Å; F40-N51 HydrophobicContact CE2-CB 3.58Å; F40-N51 WeakPolarHBondContact CE2-O 3.37Å; F40-N51 HydrophobicContact CZ-CB 3.34Å; L41-N51 WeakPolarHBondContact O-CA 3.21Å; L41-N51 WeakPolarHBondContact O-CB 3.44Å; L41-N51 PolarHBondContact O-OD1 3.07Å; K42-N51 WeakPolarHBondContact CA-OD1 3.5Å; T47-N51 PolarHBondContact O-OD1 2.9Å; E48-N51 WeakPolarHBondContact CA-OD1 3.4Å; E48-N51 VanDerWaalsContact O-CG 3.31Å; A49-N51 VanDerWaalsContact C-N 3.34Å
52	T	80.5	Confident	78.6	Confident	54 Å²	54	76 Å²	76	33%	0.331	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	166.9	-179.7	55.1	0	0	0	0	112	F40 L41 W43 D50 E54	F40-T52 WeakPolarHBondContact CA-O 3.49Å; F40-T52 VanDerWaalsContact CD2-O 3.32Å; F40-T52 WeakPolarHBondContact CD2-O 3.39Å; L41-T52 PolarHBondContact N-O 3.46Å; W43-T52 WeakPolarHBondContact CZ2-OG1 3.29Å; W43-T52 PolarHBondContact NE1-OG1 3.38Å; D50-T52 PolarHBondContact O-N 2.9Å; T52-E54 VanDerWaalsContact CB-OE1 3.29Å; T52-E54 WeakPolarHBondContact CB-OE1 3.49Å; T52-E54 PolarHBondContact OG1-OE1 3.49Å
53	W	88	Confident	78.1	Confident	76 Å²	76	83 Å²	83	29%	0.288	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.6	170.6	-72.7	91.9	0	0	0	108.8	D29 R31 E38 F39 F40	D29-W53 HydrophobicContact CB-CH2 3.87Å; D29-W53 HydrophobicContact CB-CZ3 4.44Å; R31-W53 HydrophobicContact CB-CE3 4.47Å; R31-W53 HydrophobicContact CB-CH2 4.01Å; R31-W53 HydrophobicContact CB-CZ3 3.75Å; R31-W53 HydrophobicContact CG-CD2 4.38Å; R31-W53 HydrophobicContact CG-CE3 3.59Å; R31-W53 HydrophobicContact CG-CH2 3.94Å; R31-W53 HydrophobicContact CG-CZ3 3.36Å; R31-W53 VanDerWaalsContact CZ-CD2 3.4Å; R31-W53 VanDerWaalsContact NH1-CE2 3.33Å; E38-W53 HydrophobicContact CB-CE3 4.18Å; F39-W53 WeakPolarHBondContact O-CA 2.93Å; F40-W53 HydrophobicContact CB-CD2 3.83Å; F40-W53 HydrophobicContact CB-CE3 3.78Å; F40-W53 HydrophobicContact CB-CH2 3.74Å; F40-W53 HydrophobicContact CB-CZ2 3.78Å; F40-W53 HydrophobicContact CB-CZ3 3.71Å; F40-W53 AromaticContact CD2-CD1 3.7Å; F40-W53 AromaticContact CD2-CD2 3.98Å; F40-W53 HydrophobicContact CD2-CD2 3.98Å; F40-W53 AromaticContact CD2-CE2 3.71Å; F40-W53 HydrophobicContact CD2-CG 4.02Å; F40-W53 HydrophobicContact CD2-CZ2 4.31Å; F40-W53 AromaticContact CD2-NE1 3.48Å; F40-W53 AromaticContact CE2-NE1 3.95Å; F40-W53 HydrophobicContact CG-CD2 4.3Å; F40-W53 AromaticContact CG-CE2 3.95Å; F40-W53 HydrophobicContact CG-CZ2 4.11Å
54	E	84.9	Confident	77.7	Confident	39 Å²	39	85 Å²	85	18%	0.182	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138.3	-179.3	-61.2	-53.4	138.5	0	0	110.7	E38 F39 L41 W43 T52 N58 L59	E38-E54 CarbonylContact C-O 3.59Å; E38-E54 VanDerWaalsContact CA-O 3.25Å; E38-E54 WeakPolarHBondContact CA-O 3.46Å; F39-E54 PolarHBondContact N-O 3.16Å; F39-E54 PolarHBondContact O-N 3.28Å; L41-E54 HydrophobicContact CD1-CB 3.9Å; L41-E54 HydrophobicContact CD1-CG 3.8Å; W43-E54 HydrophobicContact CH2-CG 3.88Å; W43-E54 HydrophobicContact CZ2-CG 3.55Å; T52-E54 VanDerWaalsContact CB-OE1 3.29Å; T52-E54 WeakPolarHBondContact CB-OE1 3.49Å; T52-E54 PolarHBondContact OG1-OE1 3.49Å; E54-N58 PolarHBondContact OE2-ND2 2.89Å; E54-L59 HydrophobicContact CB-CD1 4.2Å; E54-L59 HydrophobicContact CB-CD2 3.8Å; E54-L59 HydrophobicContact CB-CG 4.14Å; E54-L59 HydrophobicContact CG-CD2 4.32Å
55	P	80.4	Confident	77.7	Confident	37 Å²	37	79.3 Å²	79.3	24%	0.24	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	150.9	176.1	30.3	-34.1	0	0	0	110.9	V37 E38 D57 N58	V37-P55 CarbonylContact O-C 3.5Å; V37-P55 WeakPolarHBondContact O-CA 3.35Å; E38-P55 HydrophobicContact CG-CB 4.46Å; P55-D57 PolarHBondContact O-N 3.18Å; P55-D57 VanDerWaalsContact O-N 3.12Å; P55-N58 HydrophobicContact CG-CB 3.87Å; P55-N58 WeakPolarHBondContact O-CB 3.36Å; P55-N58 PolarHBondContact O-N 3Å
56	E	80.3	Confident	77.8	Confident	106 Å²	106	78.1 Å²	78.1	50%	0.495	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-51.7	-35.6	175.1	-174.4	176.3	175.5	0	0	112.4	V37 F39 N58 L59	V37-E56 HydrophobicContact CB-CB 4.11Å; V37-E56 WeakPolarHBondContact CB-OE2 3.34Å; V37-E56 HydrophobicContact CG1-CB 4.4Å; V37-E56 PolarHBondContact O-N 3.14Å; F39-E56 HydrophobicContact CE2-CB 4.04Å; F39-E56 HydrophobicContact CE2-CG 4.17Å; E56-N58 PolarHBondContact O-N 2.99Å; E56-N58 VanDerWaalsContact O-N 3.11Å; E56-L59 PolarHBondContact O-N 2.93Å
57	D	78.8	Confident	77.8	Confident	126 Å²	126	76 Å²	76	67%	0.674	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-60.1	-16.9	175.3	-58.4	-51.2	0	0	0	114.5	K36 P55	K36-D57 IonicContact NZ-OD2 2.61Å; K36-D57 PolarHBondContact NZ-OD2 3.23Å; P55-D57 PolarHBondContact O-N 3.18Å; P55-D57 VanDerWaalsContact O-N 3.12Å
58	N	79	Confident	77.8	Confident	93 Å²	93	73.5 Å²	73.5	50%	0.497	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-104.5	6.3	-177.9	-163.5	39.6	0	0	0	112.8	E54 P55 E56	E54-N58 PolarHBondContact OE2-ND2 2.89Å; P55-N58 HydrophobicContact CG-CB 3.87Å; P55-N58 WeakPolarHBondContact O-CB 3.36Å; P55-N58 PolarHBondContact O-N 3Å; E56-N58 PolarHBondContact O-N 2.99Å; E56-N58 VanDerWaalsContact O-N 3.11Å
59	L	79.3	Confident	78	Confident	19 Å²	19	69.5 Å²	69.5	10%	0.099	39%	0.389	C	S	.	.			trans	-123.2	94.6	-166.4	-61.7	-179.8	0	0	0	115	F39 L41 E54 E56 C61 I65	F39-L59 HydrophobicContact CB-CD1 3.87Å; F39-L59 HydrophobicContact CD2-CD1 3.67Å; F39-L59 HydrophobicContact CG-CD1 4.12Å; L41-L59 HydrophobicContact CD1-CD1 3.84Å; L41-L59 HydrophobicContact CD1-CD2 3.28Å; L41-L59 HydrophobicContact CD1-CG 4.2Å; L41-L59 HydrophobicContact CD2-CD1 4.39Å; E54-L59 HydrophobicContact CB-CD1 4.2Å; E54-L59 HydrophobicContact CB-CD2 3.8Å; E54-L59 HydrophobicContact CB-CG 4.14Å; E54-L59 HydrophobicContact CG-CD2 4.32Å; E56-L59 PolarHBondContact O-N 2.93Å; L59-C61 PolarHBondContact O-N 2.85Å; L59-I65 HydrophobicContact CB-CD1 4.03Å; L59-I65 HydrophobicContact CD1-CD1 4.31Å
60	D	76.4	Confident	78.2	Confident	168 Å²	168	71.1 Å²	71.1	90%	0.898	38%	0.38	S	S	*	.			trans	-78.2	40.5	172.3	-65.9	-65.2	0	0	0	113.7	P62	D60-P62 VanDerWaalsContact C-CD 3.49Å
61	C	77.6	Confident	78.2	Confident	22 Å²	22	70.4 Å²	70.4	15%	0.149	39%	0.385	C	S	.	.			trans	-128.7	59.9	-180	66.6	0	0	0	0	114.1	L59 E63 L64 I65	L59-C61 PolarHBondContact O-N 2.85Å; C61-E63 VanDerWaalsContact C-N 3.31Å; C61-E63 PolarHBondContact O-N 2.83Å; C61-L64 HydrophobicContact CB-CD1 4.36Å; C61-L64 PolarHBondContact O-N 2.95Å; C61-I65 PolarHBondContact O-N 2.96Å
62	P	75.7	Confident	77.5	Confident	94 Å²	94	74.2 Å²	74.2	61%	0.61	40%	0.402	S	S	*	.	H	α-helix	trans	-60.7	-32.5	-172.8	24.4	-35	0	0	0	114.2	D60 L64 I65 S66	D60-P62 VanDerWaalsContact C-CD 3.49Å; P62-L64 PolarHBondContact O-N 3.32Å; P62-I65 PolarHBondContact O-N 3.19Å; P62-S66 WeakPolarHBondContact O-CB 3.4Å; P62-S66 PolarHBondContact O-N 3.22Å; P62-S66 PolarHBondContact O-OG 3.24Å
63	E	75	Confident	76.6	Confident	165 Å²	165	78 Å²	78	77%	0.771	41%	0.414	S	S	*	.	H	α-helix	trans	-66.9	-35.2	-179.5	-63.6	-171.2	107.6	0	0	113.3	C61 S66 A67	C61-E63 VanDerWaalsContact C-N 3.31Å; C61-E63 PolarHBondContact O-N 2.83Å; E63-S66 PolarHBondContact O-OG 3.37Å; E63-S66 VanDerWaalsContact O-OG 3.11Å; E63-A67 WeakPolarHBondContact O-CB 3.32Å; E63-A67 PolarHBondContact O-N 3.35Å
64	L	76.1	Confident	75	Confident	65 Å²	65	79.2 Å²	79.2	34%	0.34	43%	0.43	S	S	.	.	H	α-helix	trans	-75.1	-36	177.2	-63	179.4	0	0	0	111.1	V24 V27 C61 P62 F68	V24-L64 HydrophobicContact CB-CD1 4.07Å; V24-L64 HydrophobicContact CG1-CD1 3.71Å; V27-L64 HydrophobicContact CG2-CB 4Å; C61-L64 HydrophobicContact CB-CD1 4.36Å; C61-L64 PolarHBondContact O-N 2.95Å; P62-L64 PolarHBondContact O-N 3.32Å; L64-F68 PolarHBondContact O-N 3.39Å
65	I	75.3	Confident	73.5	Confident	17 Å²	17	82.8 Å²	82.8	9%	0.087	45%	0.454	C	S	.	.	H	α-helix	trans	-68.9	-44.9	176.7	-68.5	165.7	0	0	0	110.4	V27 F39 L59 C61 P62 F68 L69	V27-I65 HydrophobicContact CG2-CG1 4.1Å; F39-I65 HydrophobicContact CD2-CD1 4.43Å; F39-I65 HydrophobicContact CE1-CG1 4.3Å; F39-I65 HydrophobicContact CE1-CG2 3.88Å; F39-I65 HydrophobicContact CE2-CD1 4.13Å; F39-I65 HydrophobicContact CE2-CG1 4.29Å; F39-I65 HydrophobicContact CE2-CG2 4.18Å; F39-I65 HydrophobicContact CZ-CB 4.4Å; F39-I65 HydrophobicContact CZ-CD1 4.42Å; F39-I65 HydrophobicContact CZ-CG1 4.15Å; F39-I65 HydrophobicContact CZ-CG2 3.46Å; F39-I65 VanDerWaalsContact CZ-CG2 3.46Å; L59-I65 HydrophobicContact CB-CD1 4.03Å; L59-I65 HydrophobicContact CD1-CD1 4.31Å; C61-I65 PolarHBondContact O-N 2.96Å; P62-I65 PolarHBondContact O-N 3.19Å; I65-F68 PolarHBondContact O-N 3.16Å; I65-L69 HydrophobicContact CG2-CD1 3.77Å; I65-L69 HydrophobicContact CG2-CG 4.37Å; I65-L69 WeakPolarHBondContact O-CB 3.32Å; I65-L69 VanDerWaalsContact O-CG 3.32Å; I65-L69 WeakPolarHBondContact O-CG 3.39Å; I65-L69 PolarHBondContact O-N 2.84Å
66	S	78.4	Confident	72	Confident	52 Å²	52	86.2 Å²	86.2	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-63.2	-45.1	178.6	65.8	0	0	0	0	111.7	P62 E63 F68 L69 E70	P62-S66 WeakPolarHBondContact O-CB 3.4Å; P62-S66 PolarHBondContact O-N 3.22Å; P62-S66 PolarHBondContact O-OG 3.24Å; E63-S66 PolarHBondContact O-OG 3.37Å; E63-S66 VanDerWaalsContact O-OG 3.11Å; S66-F68 VanDerWaalsContact C-N 3.31Å; S66-F68 PolarHBondContact O-N 3.19Å; S66-L69 PolarHBondContact O-N 3.36Å; S66-E70 WeakPolarHBondContact O-CB 3.48Å; S66-E70 WeakPolarHBondContact O-CG 3.4Å; S66-E70 PolarHBondContact O-N 3.37Å
67	A	75.9	Confident	70.2	Confident	55 Å²	55	88.4 Å²	88.4	46%	0.455	48%	0.484	S	S	.	.	H	α-helix	trans	-60.5	-38.5	177.3	0	0	0	0	0	112.7	E63 A71	E63-A67 WeakPolarHBondContact O-CB 3.32Å; E63-A67 PolarHBondContact O-N 3.35Å; A67-A71 WeakPolarHBondContact O-CB 3.46Å; A67-A71 PolarHBondContact O-N 3.22Å; A67-A71 VanDerWaalsContact O-N 3.16Å
68	F	78.1	Confident	68.4	Low	33 Å²	33	89.1 Å²	89.1	15%	0.145	49%	0.488	C	S	.	.	H	α-helix	trans	-66.6	-45.6	174.2	-180	-87.8	0	0	0	112	V27 Q30 L64 I65 S66 A71 Q72	V27-F68 HydrophobicContact CB-CB 4.15Å; V27-F68 HydrophobicContact CB-CD2 4.27Å; V27-F68 HydrophobicContact CB-CG 4.29Å; V27-F68 HydrophobicContact CG1-CB 3.99Å; V27-F68 HydrophobicContact CG1-CD1 4.13Å; V27-F68 HydrophobicContact CG1-CD2 3.74Å; V27-F68 HydrophobicContact CG1-CE2 4.26Å; V27-F68 HydrophobicContact CG1-CG 3.67Å; Q30-F68 HydrophobicContact CB-CD1 4.36Å; Q30-F68 HydrophobicContact CB-CE1 3.56Å; Q30-F68 HydrophobicContact CB-CZ 4.17Å; L64-F68 PolarHBondContact O-N 3.39Å; I65-F68 PolarHBondContact O-N 3.16Å; S66-F68 VanDerWaalsContact C-N 3.31Å; S66-F68 PolarHBondContact O-N 3.19Å; F68-A71 PolarHBondContact O-N 3.12Å; F68-Q72 HydrophobicContact CD1-CG 4.29Å; F68-Q72 HydrophobicContact CE1-CG 3.85Å; F68-Q72 HydrophobicContact CZ-CG 4.16Å; F68-Q72 WeakPolarHBondContact O-CG 3.45Å; F68-Q72 PolarHBondContact O-N 3.04Å
69	L	75.3	Confident	66.9	Low	54 Å²	54	90.3 Å²	90.3	28%	0.283	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-37.8	179.6	-73.5	172.4	0	0	0	113	Q30 I65 S66 Q72 K73	Q30-L69 VanDerWaalsContact OE1-CD2 3.28Å; I65-L69 HydrophobicContact CG2-CD1 3.77Å; I65-L69 HydrophobicContact CG2-CG 4.37Å; I65-L69 WeakPolarHBondContact O-CB 3.32Å; I65-L69 VanDerWaalsContact O-CG 3.32Å; I65-L69 WeakPolarHBondContact O-CG 3.39Å; I65-L69 PolarHBondContact O-N 2.84Å; S66-L69 PolarHBondContact O-N 3.36Å; L69-Q72 PolarHBondContact O-N 3.2Å; L69-K73 WeakPolarHBondContact O-CB 3.45Å; L69-K73 WeakPolarHBondContact O-CG 3.33Å; L69-K73 PolarHBondContact O-N 2.94Å
70	E	76.1	Confident	65.3	Low	126 Å²	126	96.7 Å²	96.7	59%	0.589	54%	0.535	S	S	*	.	H	α-helix	trans	-65	-45.3	174.6	-74.5	175.1	174.1	0	0	111	S66 Q72 K73 T74	S66-E70 WeakPolarHBondContact O-CB 3.48Å; S66-E70 WeakPolarHBondContact O-CG 3.4Å; S66-E70 PolarHBondContact O-N 3.37Å; E70-Q72 VanDerWaalsContact C-N 3.31Å; E70-Q72 PolarHBondContact O-N 2.87Å; E70-K73 PolarHBondContact O-N 3.42Å; E70-T74 WeakPolarHBondContact O-CG2 3.42Å; E70-T74 PolarHBondContact O-N 3.11Å; E70-T74 VanDerWaalsContact O-N 3.11Å
71	A	71.6	Confident	63.6	Low	60 Å²	60	94.2 Å²	94.2	50%	0.496	53%	0.531	S	S	.	.	H	α-helix	trans	-57.6	-43.4	174.4	0	0	0	0	0	111.9	A67 F68 T74	A67-A71 WeakPolarHBondContact O-CB 3.46Å; A67-A71 PolarHBondContact O-N 3.22Å; A67-A71 VanDerWaalsContact O-N 3.16Å; F68-A71 PolarHBondContact O-N 3.12Å; A71-T74 PolarHBondContact O-OG1 3.06Å
72	Q	64.9	Low	62.1	Low	97 Å²	97	101 Å²	101	45%	0.453	57%	0.566	S	S	.	*	H	α-helix	trans	-64.9	-44.3	175.1	-73.6	-69.8	-15.6	0	0	112.8	F68 L69 E70 T74 V75	F68-Q72 HydrophobicContact CD1-CG 4.29Å; F68-Q72 HydrophobicContact CE1-CG 3.85Å; F68-Q72 HydrophobicContact CZ-CG 4.16Å; F68-Q72 WeakPolarHBondContact O-CG 3.45Å; F68-Q72 PolarHBondContact O-N 3.04Å; L69-Q72 PolarHBondContact O-N 3.2Å; E70-Q72 VanDerWaalsContact C-N 3.31Å; E70-Q72 PolarHBondContact O-N 2.87Å; Q72-T74 PolarHBondContact O-N 2.82Å; Q72-V75 PolarHBondContact O-N 3.07Å
73	K	62.2	Low	60.5	Low	135 Å²	135	104 Å²	104	59%	0.587	57%	0.57	S	S	*	*	H	α-helix	trans	-61.9	-38.9	-179.3	-79.9	179.1	178.3	-178.6	0	113.3	L69 E70 V75 V76 E77	L69-K73 WeakPolarHBondContact O-CB 3.45Å; L69-K73 WeakPolarHBondContact O-CG 3.33Å; L69-K73 PolarHBondContact O-N 2.94Å; E70-K73 PolarHBondContact O-N 3.42Å; K73-V75 PolarHBondContact O-N 2.99Å; K73-V75 VanDerWaalsContact O-N 3.12Å; K73-V76 PolarHBondContact O-N 2.66Å; K73-E77 PolarHBondContact O-N 2.84Å; K73-E77 VanDerWaalsContact O-N 3.17Å
74	T	53.6	Low	59.2	Low	100 Å²	100	106.9 Å²	106.9	61%	0.613	57%	0.573	S	S	*	*	H	α-helix	trans	-62.6	-19.6	179	60.7	0	0	0	0	114.1	E70 A71 Q72	E70-T74 WeakPolarHBondContact O-CG2 3.42Å; E70-T74 PolarHBondContact O-N 3.11Å; E70-T74 VanDerWaalsContact O-N 3.11Å; A71-T74 PolarHBondContact O-OG1 3.06Å; Q72-T74 PolarHBondContact O-N 2.82Å
75	V	53.7	Low	57.7	Low	115 Å²	115	113.1 Å²	113.1	70%	0.697	60%	0.598	S	S	*	*	H	α-helix	trans	-82.2	-23	173.7	-176.4	0	0	0	0	112.1	Q72 K73	Q72-V75 PolarHBondContact O-N 3.07Å; K73-V75 PolarHBondContact O-N 2.99Å; K73-V75 VanDerWaalsContact O-N 3.12Å
76	V	49.5	Very low	56.3	Low	108 Å²	108	116.8 Å²	116.8	66%	0.655	63%	0.625	S	S	*	*	H	α-helix	trans	-97.1	-24.1	-173.5	-175.3	0	0	0	0	112.7	K73 N78	K73-V76 PolarHBondContact O-N 2.66Å; V76-N78 PolarHBondContact O-N 3.37Å
77	E	42.1	Very low	54.4	Low	152 Å²	152	119.1 Å²	119.1	71%	0.71	64%	0.641	S	S	*	*	S	Bend	trans	-77.6	23.8	-178.9	-71.2	-163.9	93.3	0	0	115.8	K73	K73-E77 PolarHBondContact O-N 2.84Å; K73-E77 VanDerWaalsContact O-N 3.17Å
78	N	40.1	Very low	52.6	Low	142 Å²	142	122.7 Å²	122.7	76%	0.759	66%	0.657	S	S	*	*			trans	-129.3	72.2	167.3	-80.8	-61.5	0	0	0	112.3	V76 D80	V76-N78 PolarHBondContact O-N 3.37Å; N78-D80 PolarHBondContact O-N 3.35Å
79	P	48	Very low	50.4	Low	117 Å²	117	128.5 Å²	128.5	76%	0.76	69%	0.69	S	S	*	*			trans	-83.2	42.6	-176.5	37	-38.4	0	0	0	113.7
80	D	45.3	Very low	48.7	Very low	154 Å²	154	133.3 Å²	133.3	82%	0.824	71%	0.711	S	S	*	*			trans	-154	86.6	177.8	-117	-40.8	0	0	0	113.9	N78	N78-D80 PolarHBondContact O-N 3.35Å
81	S	41.2	Very low	47.1	Very low	116 Å²	116	133.2 Å²	133.2	81%	0.811	72%	0.722	S	S	*	*			trans	-179.4	74.5	147.4	38.3	0	0	0	0	112.2
82	N	45.9	Very low	45.4	Very low	165 Å²	165	138.1 Å²	138.1	88%	0.882	73%	0.734	S	S	*	*			trans	-60.5	139.4	156	-174	3.4	0	0	0	109
83	K	42.2	Very low	43.9	Very low	157 Å²	157	140.5 Å²	140.5	68%	0.683	76%	0.756	S	S	*	*			trans	107.4	92.1	159.7	-159.7	179.3	-165.8	171	0	118.6
84	R	47.9	Very low	42.7	Very low	224 Å²	224	143.1 Å²	143.1	85%	0.845	77%	0.77	S	S	*	*			trans	68.3	131.9	146.1	-52.3	170.6	-177.5	-176.7	-3.7	115.3
85	K	44.6	Very low	41.8	Very low	196 Å²	196	142 Å²	142	85%	0.852	78%	0.778	S	S	*	*				-177.4	163.4	69.1	-165.8	170.6	-179.1	-176.4	0	110.1
86	S	45	Very low	40.9	Very low	94 Å²	94	142.6 Å²	142.6	66%	0.657	78%	0.778	S	S	*	*			trans	-49.7	161.8	167.9	60.6	0	0	0	0	112.9
87	S	39.9	Very low	40.5	Very low	101 Å²	101	145.5 Å²	145.5	71%	0.706	78%	0.781	S	S	*	*			cis	-169.3	157.7	47.5	-36.5	0	0	0	0	112.9
88	T	37	Very low	40.4	Very low	130 Å²	130	143.2 Å²	143.2	80%	0.798	79%	0.789	S	S	*	*			trans	5.7	125.4	144.5	-51.2	0	0	0	0	119.3
89	D	32.3	Very low	40.5	Very low	155 Å²	155	145.4 Å²	145.4	83%	0.829	79%	0.791	S	S	*	*				-167.5	145.8	100.8	-145.5	-154.9	0	0	0	112
90	E	39	Very low	39.9	Very low	155 Å²	155	149.4 Å²	149.4	72%	0.724	80%	0.797	S	S	*	*			trans	-89.3	168	169	-75	-109.7	99.8	0	0	110
91	P	43.8	Very low	39.5	Very low	125 Å²	125	151.8 Å²	151.8	81%	0.812	80%	0.8	S	S	*	*				-145.1	159.1	98.1	34.5	-17	0	0	0	116.8
92	E	35.7	Very low	39.7	Very low	162 Å²	162	155.3 Å²	155.3	76%	0.757	80%	0.801	S	S	*	*			trans	-61.3	162	-171.8	-53.9	166	104.5	0	0	117.3
93	T	33.6	Very low	39.4	Very low	148 Å²	148	154.9 Å²	154.9	91%	0.908	80%	0.798	S	S	*	*				-160.1	131.4	126.7	6.4	0	0	0	0	113
94	E	36.3	Very low	39.4	Very low	190 Å²	190	152.1 Å²	152.1	89%	0.888	79%	0.794	S	S	*	*			trans	-71.4	168	174.8	-52.3	-169.5	111.7	0	0	112.5
95	G	34.6	Very low	39.2	Very low	76 Å²	76	146.3 Å²	146.3	78%	0.784	79%	0.788	S	S	*	*			cis	-179.1	-169.3	6.2	0	0	0	0	0	108.3
96	N	35.7	Very low	39.3	Very low	128 Å²	128	144.6 Å²	144.6	68%	0.684	79%	0.788	S	S	*	*			cis	-164.9	121.7	5.8	177.9	40	0	0	0	111.7
97	K	40.8	Very low	39.7	Very low	168 Å²	168	146.9 Å²	146.9	73%	0.73	79%	0.786	S	S	*	*			trans	42.7	128	148.9	-63.4	178.7	-166.1	88.3	0	123.7
98	A	38.9	Very low	40.6	Very low	105 Å²	105	145.6 Å²	145.6	87%	0.868	78%	0.776	S	S	*	*				-146	109.7	126.2	0	0	0	0	0	112.9
99	K	42.1	Very low	42	Very low	188 Å²	188	146.3 Å²	146.3	82%	0.817	76%	0.763	S	S	*	*			trans	-47.3	144.6	179.1	-53.9	157.5	-177.4	175.4	0	112.5
100	K	35.9	Very low	43.9	Very low	201 Å²	201	139.1 Å²	139.1	87%	0.874	73%	0.726	S	S	*	*			cis	-148.4	171.3	27.6	-54.8	163	178.5	171.8	0	108
101	K	37	Very low	45.4	Very low	203 Å²	203	133.3 Å²	133.3	88%	0.883	70%	0.699	S	S	*	*			cis	-123.6	147.6	2.9	-51.4	171.2	-174.1	172.4	0	109.1
102	K	45.6	Very low	46.4	Very low	191 Å²	191	130.7 Å²	130.7	83%	0.83	69%	0.687	S	S	*	*			trans	-166.8	110.4	172.3	-171.5	175.4	-176.1	178.9	0	109.8
103	D	39.5	Very low	47.9	Very low	155 Å²	155	125.4 Å²	125.4	83%	0.829	66%	0.661	S	S	*	*			trans	-171.5	59.1	157.9	-148.7	-105	0	0	0	114.6
104	V	42.3	Very low	49.8	Very low	100 Å²	100	123.7 Å²	123.7	61%	0.606	66%	0.655	S	S	*	*	S	Bend	trans	-152.6	31	160.1	-149.8	0	0	0	0	112.9	R109	V104-R109 VanDerWaalsContact CG1-NH2 3.32Å; V104-R109 PolarHBondContact O-NH2 2.68Å
105	S	43.6	Very low	51.7	Low	102 Å²	102	117 Å²	117	71%	0.713	62%	0.624	S	S	*	*	S	Bend	trans	-109.2	-9.8	-170.9	-165.8	0	0	0	0	115.1
106	D	47.2	Very low	53.8	Low	160 Å²	160	118 Å²	118	86%	0.856	61%	0.612	S	S	*	*	S	Bend	trans	-124.2	22.4	-172.9	-124.7	-72.9	0	0	0	112.4
107	K	52	Low	56.2	Low	142 Å²	142	112.9 Å²	112.9	62%	0.617	59%	0.586	S	S	*	*	S	Bend	trans	-96.8	131.4	162.3	-117.1	67.1	173.5	-174.1	0	107.1	R109	K107-R109 PolarHBondContact O-N 3.05Å
108	P	60.3	Low	58.5	Low	74 Å²	74	108.6 Å²	108.6	48%	0.481	57%	0.568	S	S	.	*			trans	-54.5	131.7	162.7	24.4	-31.7	0	0	0	107.6	A112 R113	P108-A112 HydrophobicContact CB-CB 3.72Å; P108-R113 HydrophobicContact CB-CG 4.26Å; P108-R113 HydrophobicContact CG-CG 4.29Å; P108-R113 VanDerWaalsContact O-CD 3.29Å; P108-R113 WeakPolarHBondContact O-CD 3.45Å; P108-R113 WeakPolarHBondContact O-CG 3.23Å
109	R	66.3	Low	60.8	Low	144 Å²	144	109.6 Å²	109.6	54%	0.543	55%	0.55	S	S	.	.			trans	-110.8	153.1	177.1	-71.3	-161.8	-164.9	-169.8	7.9	110.8	V104 K107 A112 D143	V104-R109 VanDerWaalsContact CG1-NH2 3.32Å; V104-R109 PolarHBondContact O-NH2 2.68Å; K107-R109 PolarHBondContact O-N 3.05Å; R109-A112 WeakPolarHBondContact O-CB 3.46Å; R109-A112 PolarHBondContact O-N 3.41Å; R109-D143 WeakPolarHBondContact CB-OD1 3.47Å; R109-D143 WeakPolarHBondContact CG-OD1 3.38Å
110	G	72.2	Confident	63	Low	5 Å²	5	100.6 Å²	100.6	5%	0.052	51%	0.511	C	S	.	.	G	3₁₀ helix	trans	60	-137.6	177.6	0	0	0	0	0	112.3	A112 R113 W136 D143	G110-A112 PolarHBondContact O-N 2.73Å; G110-R113 WeakPolarHBondContact O-CB 3.4Å; G110-R113 WeakPolarHBondContact O-CG 3.42Å; G110-R113 PolarHBondContact O-N 2.87Å; G110-W136 VanDerWaalsContact C-CZ2 3.41Å; G110-D143 WeakPolarHBondContact CA-OD2 3.31Å; G110-D143 PolarHBondContact N-OD2 2.96Å
111	F	69.1	Low	65.4	Low	33 Å²	33	95.2 Å²	95.2	15%	0.145	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-60.5	-18.8	-179.9	-68.4	-66.7	0	0	0	114.5	R113 S114 P117 W136 V145 E149 R153	F111-R113 PolarHBondContact O-N 3.12Å; F111-S114 PolarHBondContact O-N 2.82Å; F111-P117 HydrophobicContact CE1-CG 4.29Å; F111-W136 AromaticContact CD1-CH2 3.45Å; F111-W136 HydrophobicContact CD1-CH2 3.45Å; F111-W136 VanDerWaalsContact CD1-CH2 3.45Å; F111-W136 AromaticContact CD1-CZ3 3.57Å; F111-W136 HydrophobicContact CD1-CZ3 3.57Å; F111-W136 HydrophobicContact CD2-CH2 4.19Å; F111-W136 AromaticContact CE1-CH2 3.53Å; F111-W136 HydrophobicContact CE1-CH2 3.53Å; F111-W136 AromaticContact CE1-CZ3 3.6Å; F111-W136 HydrophobicContact CE1-CZ3 3.6Å; F111-W136 HydrophobicContact CE2-CH2 4.29Å; F111-W136 AromaticContact CG-CH2 3.79Å; F111-W136 HydrophobicContact CG-CH2 3.79Å; F111-W136 HydrophobicContact CG-CZ3 4.33Å; F111-W136 AromaticContact CZ-CH2 3.96Å; F111-W136 HydrophobicContact CZ-CH2 3.96Å; F111-W136 HydrophobicContact CZ-CZ3 4.41Å; F111-V145 HydrophobicContact CD2-CG1 3.88Å; F111-V145 HydrophobicContact CE2-CG1 3.35Å; F111-V145 HydrophobicContact CZ-CG1 4.26Å; F111-E149 HydrophobicContact CD2-CG 3.7Å; F111-E149 HydrophobicContact CE2-CB 4.33Å; F111-E149 HydrophobicContact CE2-CG 3.78Å; F111-R153 HydrophobicContact CD1-CB 4.2Å; F111-R153 HydrophobicContact CD1-CG 4.14Å; F111-R153 HydrophobicContact CD2-CG 4.05Å; F111-R153 HydrophobicContact CE1-CB 3.57Å; F111-R153 HydrophobicContact CE1-CG 3.97Å; F111-R153 HydrophobicContact CE2-CB 3.97Å; F111-R153 HydrophobicContact CE2-CG 3.82Å; F111-R153 HydrophobicContact CG-CG 4.2Å; F111-R153 HydrophobicContact CZ-CB 3.45Å; F111-R153 VanDerWaalsContact CZ-CB 3.45Å; F111-R153 HydrophobicContact CZ-CG 3.81Å
112	A	66.2	Low	67.7	Low	69 Å²	69	86.7 Å²	86.7	57%	0.57	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-62.7	-20.9	173.6	0	0	0	0	0	112.7	P108 R109 G110 S114	P108-A112 HydrophobicContact CB-CB 3.72Å; R109-A112 WeakPolarHBondContact O-CB 3.46Å; R109-A112 PolarHBondContact O-N 3.41Å; G110-A112 PolarHBondContact O-N 2.73Å; A112-S114 PolarHBondContact O-N 2.88Å
113	R	67.4	Low	69.7	Low	51 Å²	51	80 Å²	80	19%	0.192	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-72.5	-12	174.2	-60	172.3	77	-156	2.5	112.9	P108 G110 F111 L115 W136 S139 E141 D143	P108-R113 HydrophobicContact CB-CG 4.26Å; P108-R113 HydrophobicContact CG-CG 4.29Å; P108-R113 VanDerWaalsContact O-CD 3.29Å; P108-R113 WeakPolarHBondContact O-CD 3.45Å; P108-R113 WeakPolarHBondContact O-CG 3.23Å; G110-R113 WeakPolarHBondContact O-CB 3.4Å; G110-R113 WeakPolarHBondContact O-CG 3.42Å; G110-R113 PolarHBondContact O-N 2.87Å; F111-R113 PolarHBondContact O-N 3.12Å; R113-L115 HydrophobicContact CB-CD1 4.03Å; R113-L115 HydrophobicContact CB-CG 3.91Å; R113-L115 PolarHBondContact O-N 2.9Å; R113-L115 VanDerWaalsContact O-N 3.16Å; R113-W136 VanDerWaalsContact NH1-CD1 3.29Å; R113-S139 PolarHBondContact NH1-OG 3.3Å; R113-S139 PolarHBondContact NH2-OG 3.27Å; R113-E141 IonicContact CZ-OE2 3.93Å; R113-E141 VanDerWaalsContact CZ-OE2 3.31Å; R113-E141 IonicContact NE-OE2 2.66Å; R113-E141 PolarHBondContact NH1-O 3.41Å; R113-E141 IonicContact NH1-OE2 2.87Å; R113-E141 IonicContact NH2-OE2 3.46Å; R113-E141 PolarHBondContact NH2-OE2 3.15Å; R113-D143 IonicContact NH1-OD2 2.68Å; R113-D143 PolarHBondContact NH1-OD2 3.14Å
114	S	73.1	Confident	71.9	Confident	112 Å²	112	75.5 Å²	75.5	78%	0.783	42%	0.419	S	S	*	.			trans	55	25	-174.3	-51.9	0	0	0	0	114	F111 A112	F111-S114 PolarHBondContact O-N 2.82Å; A112-S114 PolarHBondContact O-N 2.88Å
115	L	75.4	Confident	73.6	Confident	49 Å²	49	76.7 Å²	76.7	26%	0.257	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-83.7	148.7	174.5	-63.4	175.1	0	0	0	110.3	R113 W136	R113-L115 HydrophobicContact CB-CD1 4.03Å; R113-L115 HydrophobicContact CB-CG 3.91Å; R113-L115 PolarHBondContact O-N 2.9Å; R113-L115 VanDerWaalsContact O-N 3.16Å; L115-W136 HydrophobicContact CB-CB 3.89Å; L115-W136 HydrophobicContact CB-CD2 4.26Å; L115-W136 HydrophobicContact CB-CE3 3.97Å; L115-W136 HydrophobicContact CB-CG 4.22Å; L115-W136 HydrophobicContact CD1-CB 3.76Å; L115-W136 HydrophobicContact CD1-CG 4.16Å; L115-W136 HydrophobicContact CG-CB 4.49Å; L115-W136 VanDerWaalsContact O-CE3 3.3Å; L115-W136 WeakPolarHBondContact O-CZ3 3.31Å
116	D	78.4	Confident	74.4	Confident	97 Å²	97	74.1 Å²	74.1	52%	0.519	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-67.6	132.7	169.5	-91.9	-3.8	0	0	0	110.1	K137	D116-K137 HydrophobicContact CB-CB 4.22Å; D116-K137 HydrophobicContact CB-CD 3.61Å; D116-K137 HydrophobicContact CB-CG 3.96Å; D116-K137 PolarHBondContact O-N 3.07Å; D116-K137 IonicContact OD2-NZ 3.85Å; D116-K137 PolarHBondContact OD2-NZ 3.33Å
117	P	87.4	Confident	75.1	Confident	22 Å²	22	70.8 Å²	70.8	14%	0.143	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	133.8	169.6	25.9	-28.7	0	0	0	110	F111 M134 W136 C154 V157	F111-P117 HydrophobicContact CE1-CG 4.29Å; P117-M134 HydrophobicContact CB-CE 4.13Å; P117-M134 HydrophobicContact CB-CG 4.06Å; P117-M134 HydrophobicContact CB-SD 3.56Å; P117-M134 VanDerWaalsContact CB-SD 3.56Å; P117-W136 HydrophobicContact CB-CE3 4.22Å; P117-W136 HydrophobicContact CB-CZ3 3.95Å; P117-W136 HydrophobicContact CG-CZ3 4.44Å; P117-C154 HydrophobicContact CB-CB 4.32Å; P117-C154 HydrophobicContact CG-CB 3.38Å; P117-V157 HydrophobicContact CG-CG2 4.46Å
118	E	87.9	Confident	76.2	Confident	77 Å²	77	67.3 Å²	67.3	36%	0.36	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-51	177.4	-173.3	-172.1	122.1	0	0	111.1	K135 K137	E118-K135 HydrophobicContact CB-CG 4.48Å; E118-K135 PolarHBondContact N-O 2.86Å; E118-K135 IonicContact OE1-NZ 3.31Å; E118-K135 PolarHBondContact OE1-NZ 3.32Å; E118-K135 IonicContact OE2-NZ 2.74Å; E118-K135 PolarHBondContact OE2-NZ 3.39Å; E118-K137 HydrophobicContact CB-CG 3.91Å; E118-K137 HydrophobicContact CG-CG 4.37Å
119	R	88	Confident	77.1	Confident	126 Å²	126	67.6 Å²	67.6	48%	0.475	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	151	-178.1	-153.8	-171.1	-52.4	-119.4	-1.8	111.2	K135 E164	R119-K135 PolarHBondContact N-O 2.86Å; R119-K135 WeakPolarHBondContact O-CB 3.43Å; R119-K135 PolarHBondContact O-N 2.88Å; R119-E164 IonicContact NH1-OE1 3.71Å
120	I	89	Confident	77.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	125.2	163	-61.7	161.2	0	0	0	108.3	G122 F132 M134 V157 V158 F161	I120-G122 VanDerWaalsContact CG2-O 3.22Å; I120-G122 WeakPolarHBondContact CG2-O 3.35Å; I120-F132 HydrophobicContact CD1-CB 4.15Å; I120-F132 HydrophobicContact CD1-CD1 4.04Å; I120-F132 HydrophobicContact CD1-CD2 3.73Å; I120-F132 HydrophobicContact CD1-CE1 4.36Å; I120-F132 HydrophobicContact CD1-CE2 4.05Å; I120-F132 HydrophobicContact CD1-CG 3.72Å; I120-F132 HydrophobicContact CD1-CZ 4.36Å; I120-F132 HydrophobicContact CG1-CB 4.06Å; I120-F132 HydrophobicContact CG1-CG 4.18Å; I120-F132 HydrophobicContact CG2-CB 3.78Å; I120-F132 HydrophobicContact CG2-CD1 3.79Å; I120-F132 HydrophobicContact CG2-CG 3.99Å; I120-M134 HydrophobicContact CD1-CE 4.24Å; I120-M134 HydrophobicContact CG1-CE 3.69Å; I120-M134 HydrophobicContact CG1-SD 3.79Å; I120-V157 HydrophobicContact CG1-CG1 4.25Å; I120-V158 HydrophobicContact CD1-CB 4.26Å; I120-V158 HydrophobicContact CD1-CG2 3.88Å; I120-F161 HydrophobicContact CB-CB 4.05Å; I120-F161 HydrophobicContact CB-CD2 3.55Å; I120-F161 HydrophobicContact CB-CE2 4.13Å; I120-F161 HydrophobicContact CB-CG 3.84Å; I120-F161 HydrophobicContact CD1-CB 4.07Å; I120-F161 HydrophobicContact CD1-CG 4.25Å; I120-F161 HydrophobicContact CG2-CD1 4.34Å; I120-F161 HydrophobicContact CG2-CD2 3.42Å; I120-F161 VanDerWaalsContact CG2-CD2 3.42Å; I120-F161 HydrophobicContact CG2-CE1 4.4Å; I120-F161 HydrophobicContact CG2-CE2 3.47Å; I120-F161 VanDerWaalsContact CG2-CE2 3.47Å; I120-F161 HydrophobicContact CG2-CG 3.88Å; I120-F161 HydrophobicContact CG2-CZ 3.99Å; I120-F161 WeakPolarHBondContact O-CD2 3.4Å
121	I	86.7	Confident	78.5	Confident	88 Å²	88	64.9 Å²	64.9	45%	0.451	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-45.4	178.4	-57	178.2	0	0	0	109.6	L133 K135 A142 R165	I121-L133 HydrophobicContact CB-CD2 4.17Å; I121-L133 HydrophobicContact CB-CG 4.29Å; I121-L133 HydrophobicContact CD1-CD2 4.37Å; I121-L133 HydrophobicContact CD1-CG 4.38Å; I121-L133 HydrophobicContact CG2-CD2 4.3Å; I121-L133 PolarHBondContact N-O 2.83Å; I121-K135 HydrophobicContact CD1-CB 4.09Å; I121-K135 HydrophobicContact CG1-CB 4.06Å; I121-A142 HydrophobicContact CD1-CB 3.96Å; I121-R165 PolarHBondContact O-NH2 3.11Å
122	G	83.8	Confident	79.3	Confident	24 Å²	24	63.3 Å²	63.3	25%	0.247	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	170.1	-177.3	0	0	0	0	0	111.9	I120 L133	I120-G122 VanDerWaalsContact CG2-O 3.22Å; I120-G122 WeakPolarHBondContact CG2-O 3.35Å; G122-L133 PolarHBondContact O-N 2.76Å
123	A	88.7	Confident	80.3	Confident	49 Å²	49	62.9 Å²	62.9	41%	0.405	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	147.9	173.4	0	0	0	0	0	109.6	L130 M131 F132 F161	A123-L130 HydrophobicContact CB-CD1 3.96Å; A123-M131 CarbonylContact C-O 3.55Å; A123-M131 VanDerWaalsContact CA-O 3.31Å; A123-M131 WeakPolarHBondContact CA-O 3.25Å; A123-F132 HydrophobicContact CB-CD1 3.78Å; A123-F132 HydrophobicContact CB-CE1 3.96Å; A123-F161 HydrophobicContact CB-CE1 3.99Å; A123-F161 HydrophobicContact CB-CZ 3.78Å
124	T	84.1	Confident	81.1	Confident	62 Å²	62	60.4 Å²	60.4	38%	0.38	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.5	178.3	-173.8	0	0	0	0	109.9	M131 L144	T124-M131 HydrophobicContact CG2-CB 4Å; T124-M131 PolarHBondContact N-O 2.91Å; T124-M131 PolarHBondContact O-N 3.39Å; T124-L144 HydrophobicContact CG2-CD2 4.07Å
125	D	78.9	Confident	81.7	Confident	125 Å²	125	57.8 Å²	57.8	67%	0.668	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	58.5	-177.2	57.8	-31.8	0	0	0	111.8	S127 G128 E129	D125-S127 PolarHBondContact O-N 3.17Å; D125-S127 VanDerWaalsContact O-N 3.16Å; D125-G128 PolarHBondContact O-N 2.92Å; D125-E129 CarbonylContact C-O 3.58Å
126	S	61.2	Low	82.2	Confident	48 Å²	48	55.4 Å²	55.4	34%	0.336	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	119.9	176.3	61.1	0	0	0	0	110.5	G128 E129 M131	S126-G128 PolarHBondContact O-N 3.05Å; S126-G128 VanDerWaalsContact O-N 3.15Å; S126-E129 PolarHBondContact N-O 2.81Å; S126-E129 PolarHBondContact O-N 3.17Å; S126-E129 VanDerWaalsContact O-N 3.08Å; S126-M131 WeakPolarHBondContact OG-CG 3.48Å
127	S	61.3	Low	82.4	Confident	90 Å²	90	54.8 Å²	54.8	63%	0.629	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	27.6	-177.1	45.8	0	0	0	0	114.7	D125 E129	D125-S127 PolarHBondContact O-N 3.17Å; D125-S127 VanDerWaalsContact O-N 3.16Å; S127-E129 PolarHBondContact O-N 3.03Å
128	G	74.7	Confident	81.8	Confident	69 Å²	69	61.7 Å²	61.7	71%	0.711	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	0.6	-178.3	0	0	0	0	0	114.9	D125 S126	D125-G128 PolarHBondContact O-N 2.92Å; S126-G128 PolarHBondContact O-N 3.05Å; S126-G128 VanDerWaalsContact O-N 3.15Å
129	E	78.8	Confident	81.2	Confident	80 Å²	80	58.7 Å²	58.7	37%	0.374	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	133.4	165.1	-176.9	159.3	-153	0	0	109.9	D125 S126 S127 M131	D125-E129 CarbonylContact C-O 3.58Å; S126-E129 PolarHBondContact N-O 2.81Å; S126-E129 PolarHBondContact O-N 3.17Å; S126-E129 VanDerWaalsContact O-N 3.08Å; S127-E129 PolarHBondContact O-N 3.03Å; E129-M131 HydrophobicContact CG-SD 4.48Å; E129-M131 PolarHBondContact O-N 2.83Å
130	L	81.9	Confident	80.6	Confident	64 Å²	64	60.4 Å²	60.4	34%	0.335	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	113.7	176.4	-173.8	69.6	0	0	0	110.1	A123 F132 A147 Y162	A123-L130 HydrophobicContact CB-CD1 3.96Å; L130-F132 HydrophobicContact CD2-CE1 3.95Å; L130-F132 HydrophobicContact CD2-CZ 3.96Å; L130-F132 HydrophobicContact CG-CE1 4.3Å; L130-A147 HydrophobicContact CB-CB 3.98Å; L130-A147 HydrophobicContact CD2-CB 3.83Å; L130-A147 HydrophobicContact CG-CB 3.97Å; L130-A147 WeakPolarHBondContact O-CB 3.38Å; L130-A147 PolarHBondContact O-N 2.61Å; L130-Y162 WeakPolarHBondContact CD2-OH 3.37Å
131	M	86.3	Confident	79.7	Confident	27 Å²	27	65.7 Å²	65.7	13%	0.133	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	137.8	173.5	-59.6	-64.6	-80.4	0	0	110.3	A123 T124 S126 E129 L144 V145 P146	A123-M131 CarbonylContact C-O 3.55Å; A123-M131 VanDerWaalsContact CA-O 3.31Å; A123-M131 WeakPolarHBondContact CA-O 3.25Å; T124-M131 HydrophobicContact CG2-CB 4Å; T124-M131 PolarHBondContact N-O 2.91Å; T124-M131 PolarHBondContact O-N 3.39Å; S126-M131 WeakPolarHBondContact OG-CG 3.48Å; E129-M131 HydrophobicContact CG-SD 4.48Å; E129-M131 PolarHBondContact O-N 2.83Å; M131-L144 HydrophobicContact CB-CD2 4.39Å; M131-L144 HydrophobicContact CE-CB 4.06Å; M131-V145 WeakPolarHBondContact CA-O 3.37Å; M131-P146 HydrophobicContact CE-CG 3.96Å; M131-P146 VanDerWaalsContact SD-CA 3.5Å; M131-P146 HydrophobicContact SD-CB 3.99Å; M131-P146 HydrophobicContact SD-CG 3.86Å
132	F	86.1	Confident	79.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	134.3	171.2	-65.7	-46.7	0	0	0	110.5	I120 A123 L130 M134 L144 V145 A147 A150 V158 F161 Y162	I120-F132 HydrophobicContact CD1-CB 4.15Å; I120-F132 HydrophobicContact CD1-CD1 4.04Å; I120-F132 HydrophobicContact CD1-CD2 3.73Å; I120-F132 HydrophobicContact CD1-CE1 4.36Å; I120-F132 HydrophobicContact CD1-CE2 4.05Å; I120-F132 HydrophobicContact CD1-CG 3.72Å; I120-F132 HydrophobicContact CD1-CZ 4.36Å; I120-F132 HydrophobicContact CG1-CB 4.06Å; I120-F132 HydrophobicContact CG1-CG 4.18Å; I120-F132 HydrophobicContact CG2-CB 3.78Å; I120-F132 HydrophobicContact CG2-CD1 3.79Å; I120-F132 HydrophobicContact CG2-CG 3.99Å; A123-F132 HydrophobicContact CB-CD1 3.78Å; A123-F132 HydrophobicContact CB-CE1 3.96Å; L130-F132 HydrophobicContact CD2-CE1 3.95Å; L130-F132 HydrophobicContact CD2-CZ 3.96Å; L130-F132 HydrophobicContact CG-CE1 4.3Å; F132-M134 PolarHBondContact O-N 3.36Å; F132-L144 WeakPolarHBondContact O-CA 3.47Å; F132-V145 PolarHBondContact N-O 3.06Å; F132-V145 PolarHBondContact O-N 2.83Å; F132-A147 HydrophobicContact CD2-CB 3.9Å; F132-A147 HydrophobicContact CE2-CB 3.4Å; F132-A147 VanDerWaalsContact CE2-CB 3.4Å; F132-A147 HydrophobicContact CZ-CB 3.79Å; F132-A150 HydrophobicContact CD2-CB 3.64Å; F132-A150 HydrophobicContact CE2-CB 4.05Å; F132-V158 HydrophobicContact CD2-CG2 4.46Å; F132-V158 HydrophobicContact CE2-CG1 3.77Å; F132-V158 HydrophobicContact CE2-CG2 3.94Å; F132-V158 HydrophobicContact CZ-CG1 3.76Å; F132-F161 HydrophobicContact CD1-CE1 4.4Å; F132-F161 HydrophobicContact CE1-CD1 4.21Å; F132-F161 HydrophobicContact CE1-CE1 4.01Å; F132-Y162 HydrophobicContact CZ-CE2 4.01Å
133	L	87.1	Confident	79.2	Confident	60 Å²	60	62.9 Å²	62.9	31%	0.314	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	98.7	166	-177.1	63.5	0	0	0	108.3	I121 G122 A142 L144	I121-L133 HydrophobicContact CB-CD2 4.17Å; I121-L133 HydrophobicContact CB-CG 4.29Å; I121-L133 HydrophobicContact CD1-CD2 4.37Å; I121-L133 HydrophobicContact CD1-CG 4.38Å; I121-L133 HydrophobicContact CG2-CD2 4.3Å; I121-L133 PolarHBondContact N-O 2.83Å; G122-L133 PolarHBondContact O-N 2.76Å; L133-A142 HydrophobicContact CD1-CB 3.8Å; L133-A142 HydrophobicContact CG-CB 4.14Å; L133-L144 HydrophobicContact CB-CD2 4.25Å; L133-L144 HydrophobicContact CD1-CD2 4.2Å
134	M	84.4	Confident	78.9	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.4	-174.8	-169.2	66.4	75.5	0	0	111.3	P117 I120 F132 W136 A142 D143 V145 A150 V157	P117-M134 HydrophobicContact CB-CE 4.13Å; P117-M134 HydrophobicContact CB-CG 4.06Å; P117-M134 HydrophobicContact CB-SD 3.56Å; P117-M134 VanDerWaalsContact CB-SD 3.56Å; I120-M134 HydrophobicContact CD1-CE 4.24Å; I120-M134 HydrophobicContact CG1-CE 3.69Å; I120-M134 HydrophobicContact CG1-SD 3.79Å; F132-M134 PolarHBondContact O-N 3.36Å; M134-W136 HydrophobicContact CB-CH2 4.39Å; M134-W136 HydrophobicContact CB-CZ2 3.81Å; M134-W136 HydrophobicContact CG-CD2 4.19Å; M134-W136 HydrophobicContact CG-CE3 4.32Å; M134-W136 HydrophobicContact CG-CH2 3.74Å; M134-W136 HydrophobicContact CG-CZ2 3.57Å; M134-W136 HydrophobicContact CG-CZ3 4.14Å; M134-A142 VanDerWaalsContact O-CA 3.23Å; M134-A142 WeakPolarHBondContact O-CA 3.22Å; M134-A142 WeakPolarHBondContact O-CB 3.04Å; M134-D143 PolarHBondContact N-O 3.08Å; M134-D143 PolarHBondContact O-N 3.33Å; M134-V145 HydrophobicContact CB-CB 4.49Å; M134-V145 HydrophobicContact CB-CG2 3.83Å; M134-A150 HydrophobicContact CE-CB 4.19Å; M134-V157 HydrophobicContact SD-CG1 4.37Å
135	K	85.1	Confident	79	Confident	56 Å²	56	62.5 Å²	62.5	24%	0.243	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.8	163.3	-171.6	173.8	-174.5	-70.4	0	109.2	E118 R119 I121	E118-K135 HydrophobicContact CB-CG 4.48Å; E118-K135 PolarHBondContact N-O 2.86Å; E118-K135 IonicContact OE1-NZ 3.31Å; E118-K135 PolarHBondContact OE1-NZ 3.32Å; E118-K135 IonicContact OE2-NZ 2.74Å; E118-K135 PolarHBondContact OE2-NZ 3.39Å; R119-K135 PolarHBondContact N-O 2.86Å; R119-K135 WeakPolarHBondContact O-CB 3.43Å; R119-K135 PolarHBondContact O-N 2.88Å; I121-K135 HydrophobicContact CD1-CB 4.09Å; I121-K135 HydrophobicContact CG1-CB 4.06Å
136	W	87.5	Confident	79.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	153.6	177.5	-54.5	100.2	0	0	0	110.8	G110 F111 R113 L115 P117 M134 S139 D143 V145	G110-W136 VanDerWaalsContact C-CZ2 3.41Å; F111-W136 AromaticContact CD1-CH2 3.45Å; F111-W136 HydrophobicContact CD1-CH2 3.45Å; F111-W136 VanDerWaalsContact CD1-CH2 3.45Å; F111-W136 AromaticContact CD1-CZ3 3.57Å; F111-W136 HydrophobicContact CD1-CZ3 3.57Å; F111-W136 HydrophobicContact CD2-CH2 4.19Å; F111-W136 AromaticContact CE1-CH2 3.53Å; F111-W136 HydrophobicContact CE1-CH2 3.53Å; F111-W136 AromaticContact CE1-CZ3 3.6Å; F111-W136 HydrophobicContact CE1-CZ3 3.6Å; F111-W136 HydrophobicContact CE2-CH2 4.29Å; F111-W136 AromaticContact CG-CH2 3.79Å; F111-W136 HydrophobicContact CG-CH2 3.79Å; F111-W136 HydrophobicContact CG-CZ3 4.33Å; F111-W136 AromaticContact CZ-CH2 3.96Å; F111-W136 HydrophobicContact CZ-CH2 3.96Å; F111-W136 HydrophobicContact CZ-CZ3 4.41Å; R113-W136 VanDerWaalsContact NH1-CD1 3.29Å; L115-W136 HydrophobicContact CB-CB 3.89Å; L115-W136 HydrophobicContact CB-CD2 4.26Å; L115-W136 HydrophobicContact CB-CE3 3.97Å; L115-W136 HydrophobicContact CB-CG 4.22Å; L115-W136 HydrophobicContact CD1-CB 3.76Å; L115-W136 HydrophobicContact CD1-CG 4.16Å; L115-W136 HydrophobicContact CG-CB 4.49Å; L115-W136 VanDerWaalsContact O-CE3 3.3Å; L115-W136 WeakPolarHBondContact O-CZ3 3.31Å; P117-W136 HydrophobicContact CB-CE3 4.22Å; P117-W136 HydrophobicContact CB-CZ3 3.95Å; P117-W136 HydrophobicContact CG-CZ3 4.44Å; M134-W136 HydrophobicContact CB-CH2 4.39Å; M134-W136 HydrophobicContact CB-CZ2 3.81Å; M134-W136 HydrophobicContact CG-CD2 4.19Å; M134-W136 HydrophobicContact CG-CE3 4.32Å; M134-W136 HydrophobicContact CG-CH2 3.74Å; M134-W136 HydrophobicContact CG-CZ2 3.57Å; M134-W136 HydrophobicContact CG-CZ3 4.14Å; W136-S139 VanDerWaalsContact O-O 3.11Å; W136-D143 HydrophobicContact CZ2-CB 4.5Å; W136-D143 PolarHBondContact NE1-OD2 3.22Å; W136-V145 HydrophobicContact CH2-CG2 4.29Å; W136-V145 HydrophobicContact CZ2-CG2 3.79Å
137	K	81.7	Confident	80.6	Confident	83 Å²	83	56.6 Å²	56.6	36%	0.361	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	148.5	166.2	-61.1	-174.7	-159.7	158.3	0	109.4	D116 E118 S139	D116-K137 HydrophobicContact CB-CB 4.22Å; D116-K137 HydrophobicContact CB-CD 3.61Å; D116-K137 HydrophobicContact CB-CG 3.96Å; D116-K137 PolarHBondContact O-N 3.07Å; D116-K137 IonicContact OD2-NZ 3.85Å; D116-K137 PolarHBondContact OD2-NZ 3.33Å; E118-K137 HydrophobicContact CB-CG 3.91Å; E118-K137 HydrophobicContact CG-CG 4.37Å; K137-S139 PolarHBondContact O-N 3.16Å; K137-S139 VanDerWaalsContact O-N 3.07Å
138	D	75.3	Confident	81.7	Confident	167 Å²	167	61.7 Å²	61.7	89%	0.893	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	21.6	178.5	-50	-54	0	0	0	114.6
139	S	74.8	Confident	82.1	Confident	14 Å²	14	61.6 Å²	61.6	10%	0.098	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	124.7	179.2	159	0	0	0	0	112.1	R113 W136 K137 E141	R113-S139 PolarHBondContact NH1-OG 3.3Å; R113-S139 PolarHBondContact NH2-OG 3.27Å; W136-S139 VanDerWaalsContact O-O 3.11Å; K137-S139 PolarHBondContact O-N 3.16Å; K137-S139 VanDerWaalsContact O-N 3.07Å; S139-E141 VanDerWaalsContact C-N 3.3Å; S139-E141 PolarHBondContact OG-N 2.81Å; S139-E141 PolarHBondContact OG-O 2.82Å
140	D	74.8	Confident	82.5	Confident	162 Å²	162	57.8 Å²	57.8	87%	0.866	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	-10.6	171.5	-62.6	-44.8	0	0	0	113.4
141	E	69.7	Low	82.8	Confident	111 Å²	111	58.7 Å²	58.7	52%	0.519	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	127.6	171.5	-60.2	178.6	145.1	0	0	110.3	R113 S139	R113-E141 IonicContact CZ-OE2 3.93Å; R113-E141 VanDerWaalsContact CZ-OE2 3.31Å; R113-E141 IonicContact NE-OE2 2.66Å; R113-E141 PolarHBondContact NH1-O 3.41Å; R113-E141 IonicContact NH1-OE2 2.87Å; R113-E141 IonicContact NH2-OE2 3.46Å; R113-E141 PolarHBondContact NH2-OE2 3.15Å; S139-E141 VanDerWaalsContact C-N 3.3Å; S139-E141 PolarHBondContact OG-N 2.81Å; S139-E141 PolarHBondContact OG-O 2.82Å
142	A	79.5	Confident	82.8	Confident	41 Å²	41	63 Å²	63	34%	0.339	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137	174.9	0	0	0	0	0	111	I121 L133 M134	I121-A142 HydrophobicContact CD1-CB 3.96Å; L133-A142 HydrophobicContact CD1-CB 3.8Å; L133-A142 HydrophobicContact CG-CB 4.14Å; M134-A142 VanDerWaalsContact O-CA 3.23Å; M134-A142 WeakPolarHBondContact O-CA 3.22Å; M134-A142 WeakPolarHBondContact O-CB 3.04Å
143	D	80.9	Confident	82.6	Confident	13 Å²	13	70.8 Å²	70.8	7%	0.07	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	148.8	-175	-71.8	-65.5	0	0	0	111.9	R109 G110 R113 M134 W136 V145	R109-D143 WeakPolarHBondContact CB-OD1 3.47Å; R109-D143 WeakPolarHBondContact CG-OD1 3.38Å; G110-D143 WeakPolarHBondContact CA-OD2 3.31Å; G110-D143 PolarHBondContact N-OD2 2.96Å; R113-D143 IonicContact NH1-OD2 2.68Å; R113-D143 PolarHBondContact NH1-OD2 3.14Å; M134-D143 PolarHBondContact N-O 3.08Å; M134-D143 PolarHBondContact O-N 3.33Å; W136-D143 HydrophobicContact CZ2-CB 4.5Å; W136-D143 PolarHBondContact NE1-OD2 3.22Å; D143-V145 HydrophobicContact CB-CG2 4.49Å
144	L	82.3	Confident	82.5	Confident	100 Å²	100	68.6 Å²	68.6	52%	0.524	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127	167.9	-70.2	174.9	0	0	0	109.9	T124 M131 F132 L133	T124-L144 HydrophobicContact CG2-CD2 4.07Å; M131-L144 HydrophobicContact CB-CD2 4.39Å; M131-L144 HydrophobicContact CE-CB 4.06Å; F132-L144 WeakPolarHBondContact O-CA 3.47Å; L133-L144 HydrophobicContact CB-CD2 4.25Å; L133-L144 HydrophobicContact CD1-CD2 4.2Å
145	V	86.9	Confident	82.7	Confident	3 Å²	3	71.1 Å²	71.1	2%	0.018	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	129.4	-173.4	174.7	0	0	0	0	109.2	F111 M131 F132 M134 W136 D143 A147 A150	F111-V145 HydrophobicContact CD2-CG1 3.88Å; F111-V145 HydrophobicContact CE2-CG1 3.35Å; F111-V145 HydrophobicContact CZ-CG1 4.26Å; M131-V145 WeakPolarHBondContact CA-O 3.37Å; F132-V145 PolarHBondContact N-O 3.06Å; F132-V145 PolarHBondContact O-N 2.83Å; M134-V145 HydrophobicContact CB-CB 4.49Å; M134-V145 HydrophobicContact CB-CG2 3.83Å; W136-V145 HydrophobicContact CH2-CG2 4.29Å; W136-V145 HydrophobicContact CZ2-CG2 3.79Å; D143-V145 HydrophobicContact CB-CG2 4.49Å; V145-A147 PolarHBondContact O-N 2.9Å; V145-A150 HydrophobicContact CG1-CB 4.13Å
146	P	86.1	Confident	83	Confident	40 Å²	40	75.6 Å²	75.6	26%	0.26	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	133.2	174.8	-22.6	33.1	0	0	0	111.8	M131 R148 E149 A150	M131-P146 HydrophobicContact CE-CG 3.96Å; M131-P146 VanDerWaalsContact SD-CA 3.5Å; M131-P146 HydrophobicContact SD-CB 3.99Å; M131-P146 HydrophobicContact SD-CG 3.86Å; P146-R148 PolarHBondContact O-N 3.06Å; P146-R148 VanDerWaalsContact O-N 3.14Å; P146-E149 PolarHBondContact O-N 2.87Å; P146-A150 PolarHBondContact O-N 2.87Å; P146-A150 VanDerWaalsContact O-N 3.1Å
147	A	87.2	Confident	83.1	Confident	9 Å²	9	77 Å²	77	7%	0.074	39%	0.39	C	S	.	.	H	α-helix	trans	-56.6	-34	178.8	0	0	0	0	0	112	L130 F132 V145 E149 A150 N151	L130-A147 HydrophobicContact CB-CB 3.98Å; L130-A147 HydrophobicContact CD2-CB 3.83Å; L130-A147 HydrophobicContact CG-CB 3.97Å; L130-A147 WeakPolarHBondContact O-CB 3.38Å; L130-A147 PolarHBondContact O-N 2.61Å; F132-A147 HydrophobicContact CD2-CB 3.9Å; F132-A147 HydrophobicContact CE2-CB 3.4Å; F132-A147 VanDerWaalsContact CE2-CB 3.4Å; F132-A147 HydrophobicContact CZ-CB 3.79Å; V145-A147 PolarHBondContact O-N 2.9Å; A147-E149 VanDerWaalsContact C-N 3.33Å; A147-E149 PolarHBondContact O-N 3.07Å; A147-A150 PolarHBondContact O-N 3.3Å; A147-N151 VanDerWaalsContact O-CB 3.3Å; A147-N151 WeakPolarHBondContact O-CB 3.41Å; A147-N151 PolarHBondContact O-N 3.11Å; A147-N151 PolarHBondContact O-ND2 3.36Å; A147-N151 PolarHBondContact O-OD1 3.17Å; A147-N151 VanDerWaalsContact O-OD1 3.11Å
148	R	85.3	Confident	83.5	Confident	196 Å²	196	73.3 Å²	73.3	74%	0.74	37%	0.374	S	S	*	.	H	α-helix	trans	-54.3	-43.9	173.2	-74	178.5	150.8	-170.1	-6	113.2	P146 T152	P146-R148 PolarHBondContact O-N 3.06Å; P146-R148 VanDerWaalsContact O-N 3.14Å; R148-T152 PolarHBondContact O-OG1 3.06Å; R148-T152 VanDerWaalsContact O-OG1 3.1Å
149	E	82.4	Confident	84.2	Confident	68 Å²	68	69 Å²	69	32%	0.318	35%	0.35	S	S	.	.	H	α-helix	trans	-75.3	-46	177.7	-171.1	173	-165.4	0	0	111.2	F111 P146 A147 N151 T152 R153	F111-E149 HydrophobicContact CD2-CG 3.7Å; F111-E149 HydrophobicContact CE2-CB 4.33Å; F111-E149 HydrophobicContact CE2-CG 3.78Å; P146-E149 PolarHBondContact O-N 2.87Å; A147-E149 VanDerWaalsContact C-N 3.33Å; A147-E149 PolarHBondContact O-N 3.07Å; E149-N151 VanDerWaalsContact C-N 3.29Å; E149-N151 PolarHBondContact O-N 3.37Å; E149-T152 PolarHBondContact O-N 3.38Å; E149-R153 HydrophobicContact CG-CG 3.65Å; E149-R153 WeakPolarHBondContact O-CG 3.46Å; E149-R153 PolarHBondContact O-N 3.36Å; E149-R153 IonicContact OE1-CZ 3.61Å; E149-R153 IonicContact OE1-NE 3.06Å; E149-R153 PolarHBondContact OE1-NE 3.14Å; E149-R153 IonicContact OE1-NH2 3.22Å; E149-R153 PolarHBondContact OE1-NH2 2.87Å
150	A	87.8	Confident	84.8	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-57.7	-39.9	179	0	0	0	0	0	112.9	F132 M134 V145 P146 A147 T152 R153 C154 V158	F132-A150 HydrophobicContact CD2-CB 3.64Å; F132-A150 HydrophobicContact CE2-CB 4.05Å; M134-A150 HydrophobicContact CE-CB 4.19Å; V145-A150 HydrophobicContact CG1-CB 4.13Å; P146-A150 PolarHBondContact O-N 2.87Å; P146-A150 VanDerWaalsContact O-N 3.1Å; A147-A150 PolarHBondContact O-N 3.3Å; A150-T152 PolarHBondContact O-N 3.34Å; A150-R153 PolarHBondContact O-N 3.1Å; A150-C154 CarbonylContact O-C 3.31Å; A150-C154 VanDerWaalsContact O-C 3.31Å; A150-C154 PolarHBondContact O-N 2.88Å; A150-C154 PolarHBondContact O-SG 3.1Å; A150-C154 VanDerWaalsContact O-SG 3.36Å; A150-V158 HydrophobicContact CB-CG2 3.8Å
151	N	88.4	Confident	85.5	Confident	83 Å²	83	63.4 Å²	63.4	44%	0.444	32%	0.322	S	S	.	.	H	α-helix	trans	-59.2	-31.2	175.2	-69.3	-5.2	0	0	0	112.7	A147 E149 P155 V158	A147-N151 VanDerWaalsContact O-CB 3.3Å; A147-N151 WeakPolarHBondContact O-CB 3.41Å; A147-N151 PolarHBondContact O-N 3.11Å; A147-N151 PolarHBondContact O-ND2 3.36Å; A147-N151 PolarHBondContact O-OD1 3.17Å; A147-N151 VanDerWaalsContact O-OD1 3.11Å; E149-N151 VanDerWaalsContact C-N 3.29Å; E149-N151 PolarHBondContact O-N 3.37Å; N151-P155 WeakPolarHBondContact O-CB 3.17Å; N151-V158 WeakPolarHBondContact OD1-CG1 3.36Å
152	T	85.4	Confident	86.4	Confident	117 Å²	117	62.9 Å²	62.9	72%	0.718	32%	0.316	S	S	*	.	H	α-helix	trans	-90.3	-39.5	-177.7	-51.4	0	0	0	0	111.7	R148 E149 A150	R148-T152 PolarHBondContact O-OG1 3.06Å; R148-T152 VanDerWaalsContact O-OG1 3.1Å; E149-T152 PolarHBondContact O-N 3.38Å; A150-T152 PolarHBondContact O-N 3.34Å
153	R	82.1	Confident	86.7	Confident	164 Å²	164	67.3 Å²	67.3	62%	0.619	33%	0.33	S	S	*	.	H	α-helix	trans	-80.6	-42.7	-177.1	-64	-67.6	-168.4	177.1	2.3	113.3	F111 E149 A150	F111-R153 HydrophobicContact CD1-CB 4.2Å; F111-R153 HydrophobicContact CD1-CG 4.14Å; F111-R153 HydrophobicContact CD2-CG 4.05Å; F111-R153 HydrophobicContact CE1-CB 3.57Å; F111-R153 HydrophobicContact CE1-CG 3.97Å; F111-R153 HydrophobicContact CE2-CB 3.97Å; F111-R153 HydrophobicContact CE2-CG 3.82Å; F111-R153 HydrophobicContact CG-CG 4.2Å; F111-R153 HydrophobicContact CZ-CB 3.45Å; F111-R153 VanDerWaalsContact CZ-CB 3.45Å; F111-R153 HydrophobicContact CZ-CG 3.81Å; E149-R153 HydrophobicContact CG-CG 3.65Å; E149-R153 WeakPolarHBondContact O-CG 3.46Å; E149-R153 PolarHBondContact O-N 3.36Å; E149-R153 IonicContact OE1-CZ 3.61Å; E149-R153 IonicContact OE1-NE 3.06Å; E149-R153 PolarHBondContact OE1-NE 3.14Å; E149-R153 IonicContact OE1-NH2 3.22Å; E149-R153 PolarHBondContact OE1-NH2 2.87Å; A150-R153 PolarHBondContact O-N 3.1Å
154	C	84.2	Confident	86.8	Confident	13 Å²	13	71.6 Å²	71.6	9%	0.088	35%	0.35	C	S	.	.			trans	-144.1	57.5	-170.6	61.2	0	0	0	0	112.9	P117 A150 Q156 V157 V158	P117-C154 HydrophobicContact CB-CB 4.32Å; P117-C154 HydrophobicContact CG-CB 3.38Å; A150-C154 CarbonylContact O-C 3.31Å; A150-C154 VanDerWaalsContact O-C 3.31Å; A150-C154 PolarHBondContact O-N 2.88Å; A150-C154 PolarHBondContact O-SG 3.1Å; A150-C154 VanDerWaalsContact O-SG 3.36Å; C154-Q156 PolarHBondContact O-N 3.46Å; C154-Q156 VanDerWaalsContact O-N 3.14Å; C154-V157 HydrophobicContact CB-CB 4.38Å; C154-V157 HydrophobicContact CB-CG2 4.17Å; C154-V157 PolarHBondContact O-N 3.25Å; C154-V158 PolarHBondContact O-N 2.96Å
155	P	90.1	Very high	86.7	Confident	54 Å²	54	72 Å²	72	35%	0.351	34%	0.344	S	S	.	.	H	α-helix	trans	-55.3	-36	-175.4	19.7	-32.3	0	0	0	113.7	N151 V157 V158 I159	N151-P155 WeakPolarHBondContact O-CB 3.17Å; P155-V157 VanDerWaalsContact C-N 3.31Å; P155-V157 PolarHBondContact O-N 2.88Å; P155-V158 PolarHBondContact O-N 3.44Å; P155-I159 WeakPolarHBondContact O-CD1 3.3Å; P155-I159 VanDerWaalsContact O-CG1 3.26Å; P155-I159 WeakPolarHBondContact O-CG1 3.12Å; P155-I159 PolarHBondContact O-N 3Å
156	Q	91.3	Very high	86.5	Confident	149 Å²	149	76.5 Å²	76.5	70%	0.696	37%	0.367	S	S	*	.	H	α-helix	trans	-62	-37.2	179.9	-59.7	-59.8	-35.5	0	0	112.8	C154 S160	C154-Q156 PolarHBondContact O-N 3.46Å; C154-Q156 VanDerWaalsContact O-N 3.14Å; Q156-S160 WeakPolarHBondContact O-CB 3.41Å; Q156-S160 PolarHBondContact O-N 2.98Å; Q156-S160 VanDerWaalsContact O-N 3.11Å
157	V	89.3	Confident	85.8	Confident	31 Å²	31	79.8 Å²	79.8	19%	0.188	39%	0.387	C	S	.	.	H	α-helix	trans	-70.8	-37	177.2	-175.8	0	0	0	0	110.6	P117 I120 M134 C154 P155 F161	P117-V157 HydrophobicContact CG-CG2 4.46Å; I120-V157 HydrophobicContact CG1-CG1 4.25Å; M134-V157 HydrophobicContact SD-CG1 4.37Å; C154-V157 HydrophobicContact CB-CB 4.38Å; C154-V157 HydrophobicContact CB-CG2 4.17Å; C154-V157 PolarHBondContact O-N 3.25Å; P155-V157 VanDerWaalsContact C-N 3.31Å; P155-V157 PolarHBondContact O-N 2.88Å; V157-F161 PolarHBondContact O-N 3.24Å; V157-F161 VanDerWaalsContact O-N 3.16Å
158	V	89.2	Confident	85.2	Confident	5 Å²	5	89.3 Å²	89.3	3%	0.03	42%	0.421	C	S	.	.	H	α-helix	trans	-67.6	-45.9	175.9	-177.4	0	0	0	0	111.7	I120 F132 A150 N151 C154 P155 F161 Y162	I120-V158 HydrophobicContact CD1-CB 4.26Å; I120-V158 HydrophobicContact CD1-CG2 3.88Å; F132-V158 HydrophobicContact CD2-CG2 4.46Å; F132-V158 HydrophobicContact CE2-CG1 3.77Å; F132-V158 HydrophobicContact CE2-CG2 3.94Å; F132-V158 HydrophobicContact CZ-CG1 3.76Å; A150-V158 HydrophobicContact CB-CG2 3.8Å; N151-V158 WeakPolarHBondContact OD1-CG1 3.36Å; C154-V158 PolarHBondContact O-N 2.96Å; P155-V158 PolarHBondContact O-N 3.44Å; V158-F161 WeakPolarHBondContact O-CB 3.42Å; V158-F161 PolarHBondContact O-N 2.95Å; V158-Y162 HydrophobicContact CG1-CD2 3.79Å; V158-Y162 HydrophobicContact CG1-CE2 3.51Å; V158-Y162 VanDerWaalsContact O-CD2 3.24Å; V158-Y162 WeakPolarHBondContact O-CD2 3.42Å; V158-Y162 PolarHBondContact O-N 3.05Å
159	I	90.6	Very high	84.3	Confident	76 Å²	76	88.3 Å²	88.3	39%	0.39	42%	0.424	S	S	.	.	H	α-helix	trans	-60	-50.7	179.3	-68.7	162.1	0	0	0	109.8	P155 F161 Y162 E163	P155-I159 WeakPolarHBondContact O-CD1 3.3Å; P155-I159 VanDerWaalsContact O-CG1 3.26Å; P155-I159 WeakPolarHBondContact O-CG1 3.12Å; P155-I159 PolarHBondContact O-N 3Å; I159-F161 VanDerWaalsContact C-N 3.29Å; I159-F161 PolarHBondContact O-N 3.41Å; I159-Y162 PolarHBondContact O-N 3.41Å; I159-E163 HydrophobicContact CG2-CG 4.14Å; I159-E163 WeakPolarHBondContact O-CG 3.49Å; I159-E163 PolarHBondContact O-N 3.22Å
160	S	86.6	Confident	83.4	Confident	48 Å²	48	90.1 Å²	90.1	34%	0.336	44%	0.444	S	S	.	.	H	α-helix	trans	-55.9	-40.7	177	171.7	0	0	0	0	112.9	Q156 Y162 E163 E164	Q156-S160 WeakPolarHBondContact O-CB 3.41Å; Q156-S160 PolarHBondContact O-N 2.98Å; Q156-S160 VanDerWaalsContact O-N 3.11Å; S160-Y162 VanDerWaalsContact C-N 3.34Å; S160-Y162 PolarHBondContact O-N 2.9Å; S160-E163 PolarHBondContact O-N 3.28Å; S160-E164 WeakPolarHBondContact O-CG 3.49Å; S160-E164 PolarHBondContact O-N 3.27Å
161	F	90.6	Very high	81.8	Confident	10 Å²	10	96 Å²	96	4%	0.044	48%	0.484	C	S	.	.	H	α-helix	trans	-60.8	-39.7	176.6	169.1	-93.2	0	0	0	113.3	I120 A123 F132 V157 V158 I159 R165	I120-F161 HydrophobicContact CB-CB 4.05Å; I120-F161 HydrophobicContact CB-CD2 3.55Å; I120-F161 HydrophobicContact CB-CE2 4.13Å; I120-F161 HydrophobicContact CB-CG 3.84Å; I120-F161 HydrophobicContact CD1-CB 4.07Å; I120-F161 HydrophobicContact CD1-CG 4.25Å; I120-F161 HydrophobicContact CG2-CD1 4.34Å; I120-F161 HydrophobicContact CG2-CD2 3.42Å; I120-F161 VanDerWaalsContact CG2-CD2 3.42Å; I120-F161 HydrophobicContact CG2-CE1 4.4Å; I120-F161 HydrophobicContact CG2-CE2 3.47Å; I120-F161 VanDerWaalsContact CG2-CE2 3.47Å; I120-F161 HydrophobicContact CG2-CG 3.88Å; I120-F161 HydrophobicContact CG2-CZ 3.99Å; I120-F161 WeakPolarHBondContact O-CD2 3.4Å; A123-F161 HydrophobicContact CB-CE1 3.99Å; A123-F161 HydrophobicContact CB-CZ 3.78Å; F132-F161 HydrophobicContact CD1-CE1 4.4Å; F132-F161 HydrophobicContact CE1-CD1 4.21Å; F132-F161 HydrophobicContact CE1-CE1 4.01Å; V157-F161 PolarHBondContact O-N 3.24Å; V157-F161 VanDerWaalsContact O-N 3.16Å; V158-F161 WeakPolarHBondContact O-CB 3.42Å; V158-F161 PolarHBondContact O-N 2.95Å; I159-F161 VanDerWaalsContact C-N 3.29Å; I159-F161 PolarHBondContact O-N 3.41Å; F161-R165 VanDerWaalsContact CD2-NH1 3.3Å; F161-R165 WeakPolarHBondContact O-CD 3.45Å; F161-R165 WeakPolarHBondContact O-CG 3.26Å; F161-R165 PolarHBondContact O-NH1 3.37Å; F161-R165 VanDerWaalsContact O-NH1 3.07Å
162	Y	87.4	Confident	80.5	Confident	101 Å²	101	96.5 Å²	96.5	40%	0.396	49%	0.492	S	S	.	.	H	α-helix	trans	-75.5	-41.2	176.7	-75.7	-65	0	0	0	112.5	L130 F132 V158 I159 S160 E164 R165 L166	L130-Y162 WeakPolarHBondContact CD2-OH 3.37Å; F132-Y162 HydrophobicContact CZ-CE2 4.01Å; V158-Y162 HydrophobicContact CG1-CD2 3.79Å; V158-Y162 HydrophobicContact CG1-CE2 3.51Å; V158-Y162 VanDerWaalsContact O-CD2 3.24Å; V158-Y162 WeakPolarHBondContact O-CD2 3.42Å; V158-Y162 PolarHBondContact O-N 3.05Å; I159-Y162 PolarHBondContact O-N 3.41Å; S160-Y162 VanDerWaalsContact C-N 3.34Å; S160-Y162 PolarHBondContact O-N 2.9Å; Y162-E164 VanDerWaalsContact C-N 3.31Å; Y162-E164 PolarHBondContact O-N 3.42Å; Y162-R165 CarbonylContact O-C 3.48Å; Y162-R165 PolarHBondContact O-N 3.16Å; Y162-L166 WeakPolarHBondContact O-CG 3.24Å; Y162-L166 PolarHBondContact O-N 3.07Å
163	E	86.4	Confident	79	Confident	133 Å²	133	97.7 Å²	97.7	62%	0.621	49%	0.489	S	S	*	.	H	α-helix	trans	-58.3	-42.1	176.6	-72.5	177.5	156.9	0	0	111.8	I159 S160 R165	I159-E163 HydrophobicContact CG2-CG 4.14Å; I159-E163 WeakPolarHBondContact O-CG 3.49Å; I159-E163 PolarHBondContact O-N 3.22Å; S160-E163 PolarHBondContact O-N 3.28Å; E163-R165 PolarHBondContact O-N 3.11Å
164	E	83.8	Confident	77.7	Confident	104 Å²	104	98.3 Å²	98.3	49%	0.486	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.9	173.6	-75	178.5	173.1	0	0	114	R119 S160 Y162	R119-E164 IonicContact NH1-OE1 3.71Å; S160-E164 WeakPolarHBondContact O-CG 3.49Å; S160-E164 PolarHBondContact O-N 3.27Å; Y162-E164 VanDerWaalsContact C-N 3.31Å; Y162-E164 PolarHBondContact O-N 3.42Å
165	R	80.3	Confident	76.4	Confident	109 Å²	109	105.7 Å²	105.7	41%	0.411	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-0.6	-171	-71.9	168.6	-177.6	68.2	-1.8	114	I121 F161 Y162 E163 T167	I121-R165 PolarHBondContact O-NH2 3.11Å; F161-R165 VanDerWaalsContact CD2-NH1 3.3Å; F161-R165 WeakPolarHBondContact O-CD 3.45Å; F161-R165 WeakPolarHBondContact O-CG 3.26Å; F161-R165 PolarHBondContact O-NH1 3.37Å; F161-R165 VanDerWaalsContact O-NH1 3.07Å; Y162-R165 CarbonylContact O-C 3.48Å; Y162-R165 PolarHBondContact O-N 3.16Å; E163-R165 PolarHBondContact O-N 3.11Å; R165-T167 PolarHBondContact O-N 2.87Å
166	L	81.4	Confident	74.8	Confident	96 Å²	96	107.8 Å²	107.8	50%	0.503	56%	0.56	S	S	.	*			trans	-75.1	86.3	179.5	-95.7	158	0	0	0	111.4	Y162 W168	Y162-L166 WeakPolarHBondContact O-CG 3.24Å; Y162-L166 PolarHBondContact O-N 3.07Å; L166-W168 HydrophobicContact CD2-CZ2 4.23Å; L166-W168 PolarHBondContact O-N 3.45Å
167	T	71.9	Confident	72.9	Confident	109 Å²	109	113.6 Å²	113.6	67%	0.669	59%	0.587	S	S	*	*			trans	-83.5	106.1	170.9	53	0	0	0	0	111.1	R165 H169	R165-T167 PolarHBondContact O-N 2.87Å; T167-H169 PolarHBondContact O-N 3.12Å
168	W	74.4	Confident	72.1	Confident	210 Å²	210	117.8 Å²	117.8	80%	0.795	61%	0.607	S	S	*	*			trans	-77.4	103.6	174.9	-60.6	91.1	0	0	0	110.7	L166 S170	L166-W168 HydrophobicContact CD2-CZ2 4.23Å; L166-W168 PolarHBondContact O-N 3.45Å; W168-S170 PolarHBondContact O-N 3.24Å; W168-S170 VanDerWaalsContact O-N 3.12Å
169	H	67.6	Low	71.2	Confident	175 Å²	175	123.7 Å²	123.7	81%	0.81	64%	0.638	S	S	*	*			trans	-79	88.1	169	-70.4	-76.4	0	0	0	110.2	T167 C171	T167-H169 PolarHBondContact O-N 3.12Å; H169-C171 PolarHBondContact O-N 3.25Å
170	S	63.4	Low	70.2	Confident	105 Å²	105	126.3 Å²	126.3	73%	0.734	65%	0.651	S	S	*	*			trans	-63.8	113.7	160.8	-53.8	0	0	0	0	108.2	W168 P172	W168-S170 PolarHBondContact O-N 3.24Å; W168-S170 VanDerWaalsContact O-N 3.12Å; S170-P172 VanDerWaalsContact O-CD 3.24Å; S170-P172 WeakPolarHBondContact O-CD 3.24Å
171	C	53	Low	69.2	Low	125 Å²	125	130.9 Å²	130.9	85%	0.845	67%	0.67	S	S	*	*			trans	-63.1	120.5	176.2	-168.6	0	0	0	0	109.8	H169	H169-C171 PolarHBondContact O-N 3.25Å
172	P	61.2	Low	67.8	Low	92 Å²	92	138.5 Å²	138.5	60%	0.597	71%	0.709	S	S	*	*			trans	-78.6	154.3	174.2	-10.9	29.3	0	0	0	111.7	S170	S170-P172 VanDerWaalsContact O-CD 3.24Å; S170-P172 WeakPolarHBondContact O-CD 3.24Å
173	E	55	Low	66.5	Low	143 Å²	143	141 Å²	141	67%	0.668	73%	0.73	S	S	*	*			trans	44.6	94	165.4	-77.5	72.9	-111	0	0	119.1	E175	E173-E175 HydrophobicContact CB-CB 4.24Å; E173-E175 HydrophobicContact CG-CB 3.77Å; E173-E175 HydrophobicContact CG-CG 4.03Å
174	D	54.4	Low	65.1	Low	177 Å²	177	141.6 Å²	141.6	95%	0.947	74%	0.738	S	S	*	*			trans	-85.8	49.2	130.7	-111.7	-33	0	0	0	109.2	A176	D174-A176 PolarHBondContact O-N 3.46Å
175	E	56.3	Low	63.7	Low	168 Å²	168	144.5 Å²	144.5	79%	0.785	76%	0.757	S	S	*	*			trans	-95.5	76.4	167.7	-72.4	-155.9	139.7	0	0	110.3	E173	E173-E175 HydrophobicContact CB-CB 4.24Å; E173-E175 HydrophobicContact CG-CB 3.77Å; E173-E175 HydrophobicContact CG-CG 4.03Å
176	A	57.1	Low	62.3	Low	98 Å²	98	147.4 Å²	147.4	81%	0.81	79%	0.786	S	S	*	*			trans	-108.1	91.3	160.8	0	0	0	0	0	109.3	D174	D174-A176 PolarHBondContact O-N 3.46Å
177	Q	52.1	Low	60.6	Low	271 Å²	271	152.1 Å²	152.1	100%	1.266	81%	0.812	S	S	*	*			trans	-116.6	0	164.7	-82	-161.1	-45.2	0	0	110.8

Retrieved 177 of 177 residues in 229.4 ms (Link to these results)

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