A0A087WRX7_MOUSE Loading...

Transformed mouse 3T3 cell double minute 4

AlphaFold DB , UniProt , Accession A0A087WRX7, Species MOUSE (Mus musculus, Mouse), Gene Mdm4, Length 318 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	37.1	Very low	40	Very low	239 Å²	239	134.2 Å²	134.2	100%	1.177	81%	0.81	S	S	*	*				0	118.8	0	-60.4	177.9	96.1	0	0	105.8
2	T	39.3	Very low	40.1	Very low	106 Å²	106	131 Å²	131	65%	0.65	81%	0.808	S	S	*	*			cis	-162.1	124	6.3	23.4	0	0	0	0	104.1
3	S	36.7	Very low	40.3	Very low	122 Å²	122	129 Å²	129	85%	0.853	80%	0.803	S	S	*	*			trans	-105.7	116.6	167.7	-55.3	0	0	0	0	106.5
4	H	39.7	Very low	40.3	Very low	163 Å²	163	130.8 Å²	130.8	76%	0.755	80%	0.804	S	S	*	*			trans	-106	100.9	170.8	-65.5	-74.3	0	0	0	107.8
5	S	40.9	Very low	40.9	Very low	119 Å²	119	129.5 Å²	129.5	83%	0.832	80%	0.802	S	S	*	*			trans	-90.4	112.4	163.5	-71.4	0	0	0	0	107.8	S7	S5-S7 PolarHBondContact O-N 3.33Å
6	T	42.1	Very low	40.8	Very low	141 Å²	141	126 Å²	126	87%	0.865	79%	0.79	S	S	*	*			trans	-67.2	109.8	173.8	-49.5	0	0	0	0	109.1	A8	T6-A8 PolarHBondContact O-N 3.42Å
7	S	41.6	Very low	40.8	Very low	99 Å²	99	124.9 Å²	124.9	69%	0.692	79%	0.787	S	S	*	*			trans	-81.9	110.6	168.7	75.3	0	0	0	0	108.9	S5 Q9	S5-S7 PolarHBondContact O-N 3.33Å; S7-Q9 PolarHBondContact O-N 3.2Å
8	A	43.9	Very low	40.8	Very low	87 Å²	87	131.5 Å²	131.5	72%	0.719	79%	0.794	S	S	*	*			trans	-66.6	113.6	162.7	0	0	0	0	0	107.9	T6 C10	T6-A8 PolarHBondContact O-N 3.42Å; A8-C10 PolarHBondContact O-N 3.46Å
9	Q	45.2	Very low	40.6	Very low	176 Å²	176	132.3 Å²	132.3	82%	0.822	79%	0.792	S	S	*	*			trans	-73.3	100.4	165.3	-70.6	-179.6	-8.7	0	0	107.1	S7 S11	S7-Q9 PolarHBondContact O-N 3.2Å; Q9-S11 PolarHBondContact O-N 2.93Å
10	C	34.6	Very low	40.6	Very low	117 Å²	117	130.5 Å²	130.5	79%	0.791	79%	0.786	S	S	*	*			trans	-73.9	100.9	163.5	-64.8	0	0	0	0	107	A8 A12	A8-C10 PolarHBondContact O-N 3.46Å; C10-A12 PolarHBondContact O-N 3.11Å
11	S	39.3	Very low	40.7	Very low	107 Å²	107	129.4 Å²	129.4	75%	0.748	78%	0.784	S	S	*	*			trans	-58.3	95.9	158	-66	0	0	0	0	107.3	Q9 S13	Q9-S11 PolarHBondContact O-N 2.93Å; S11-S13 PolarHBondContact O-N 3.25Å
12	A	41.3	Very low	41.2	Very low	96 Å²	96	124.9 Å²	124.9	79%	0.793	76%	0.76	S	S	*	*			trans	-67.7	87.2	163.3	0	0	0	0	0	106.3	C10 D14	C10-A12 PolarHBondContact O-N 3.11Å; A12-D14 PolarHBondContact O-N 3.29Å
13	S	42.7	Very low	42	Very low	105 Å²	105	126.8 Å²	126.8	73%	0.734	76%	0.762	S	S	*	*			trans	-58.9	110.4	161.2	-65.9	0	0	0	0	106.2	S11 S15	S11-S13 PolarHBondContact O-N 3.25Å; S13-S15 PolarHBondContact O-N 3.38Å
14	D	39.7	Very low	43.3	Very low	154 Å²	154	126 Å²	126	82%	0.824	75%	0.747	S	S	*	*			trans	-54.7	90	172.7	-141.5	-25.7	0	0	0	107.9	A12 A16	A12-D14 PolarHBondContact O-N 3.29Å; D14-A16 PolarHBondContact O-N 2.72Å
15	S	48.8	Very low	45.1	Very low	111 Å²	111	121 Å²	121	78%	0.776	73%	0.73	S	S	*	*			trans	-75.8	60.7	168.6	61.9	0	0	0	0	107.5	S13 C17	S13-S15 PolarHBondContact O-N 3.38Å; S15-C17 PolarHBondContact O-N 3.2Å
16	A	40.6	Very low	47.4	Very low	74 Å²	74	120.2 Å²	120.2	61%	0.612	71%	0.713	S	S	*	*			trans	-66.5	88.7	162.4	0	0	0	0	0	106.1	D14 R18	D14-A16 PolarHBondContact O-N 2.72Å; A16-R18 PolarHBondContact O-N 3.29Å
17	C	39.8	Very low	49.8	Very low	108 Å²	108	113.5 Å²	113.5	73%	0.73	67%	0.672	S	S	*	*			trans	11.3	83.2	152.4	-59.7	0	0	0	0	113.4	S15 I19	S15-C17 PolarHBondContact O-N 3.2Å; C17-I19 HydrophobicContact CB-CG1 4.13Å; C17-I19 PolarHBondContact O-N 3.36Å
18	R	40.8	Very low	52.3	Low	243 Å²	243	114.8 Å²	114.8	92%	0.917	66%	0.662	S	S	*	*			trans	-68.9	76.3	148.8	-70.5	-169.8	-167.9	-169.8	4.1	105.8	A16 S20	A16-R18 PolarHBondContact O-N 3.29Å; R18-S20 PolarHBondContact O-N 3.24Å
19	I	37.9	Very low	54.8	Low	146 Å²	146	111 Å²	111	75%	0.749	63%	0.63	S	S	*	*			trans	-63.3	91.5	146.3	-50.3	176.1	0	0	0	101.4	C17 S21	C17-I19 HydrophobicContact CB-CG1 4.13Å; C17-I19 PolarHBondContact O-N 3.36Å; I19-S21 VanDerWaalsContact C-N 3.28Å; I19-S21 PolarHBondContact O-N 2.89Å
20	S	40	Very low	57.2	Low	96 Å²	96	107 Å²	107	67%	0.671	61%	0.61	S	S	*	*			trans	-50.5	108.3	163.4	44.1	0	0	0	0	103.8	R18 E22	R18-S20 PolarHBondContact O-N 3.24Å; S20-E22 VanDerWaalsContact C-N 3.33Å; S20-E22 PolarHBondContact O-N 3.32Å
21	S	43.1	Very low	60.1	Low	108 Å²	108	107 Å²	107	76%	0.755	60%	0.601	S	S	*	*			trans	-45.9	110.1	169.1	176.4	0	0	0	0	104.7	I19 Q23	I19-S21 VanDerWaalsContact C-N 3.28Å; I19-S21 PolarHBondContact O-N 2.89Å; S21-Q23 VanDerWaalsContact C-N 3.35Å; S21-Q23 PolarHBondContact O-N 3.27Å
22	E	48.1	Very low	62.7	Low	145 Å²	145	106.5 Å²	106.5	68%	0.678	59%	0.587	S	S	*	*			trans	-45.3	111	173.8	-83.4	152	151.8	0	0	104.6	S20 I24	S20-E22 VanDerWaalsContact C-N 3.33Å; S20-E22 PolarHBondContact O-N 3.32Å; E22-I24 HydrophobicContact CB-CG1 4.2Å; E22-I24 WeakPolarHBondContact O-CG1 3.47Å; E22-I24 PolarHBondContact O-N 3.43Å
23	Q	54.8	Low	65.4	Low	146 Å²	146	102 Å²	102	68%	0.682	55%	0.549	S	S	*	.			trans	-77.1	81.4	-178	-162.4	169.6	-6.5	0	0	103.3	S21 S25	S21-Q23 VanDerWaalsContact C-N 3.35Å; S21-Q23 PolarHBondContact O-N 3.27Å; Q23-S25 VanDerWaalsContact C-N 3.33Å; Q23-S25 PolarHBondContact O-N 2.94Å
24	I	63.8	Low	67.9	Low	106 Å²	106	98 Å²	98	54%	0.544	52%	0.52	S	S	.	.			trans	-63.4	99.5	-172.9	-61.5	167.7	0	0	0	106.4	E22 Q26 T48	E22-I24 HydrophobicContact CB-CG1 4.2Å; E22-I24 WeakPolarHBondContact O-CG1 3.47Å; E22-I24 PolarHBondContact O-N 3.43Å; I24-Q26 PolarHBondContact O-N 3.25Å; I24-T48 HydrophobicContact CG2-CG2 3.34Å
25	S	78	Confident	70.6	Confident	57 Å²	57	95.5 Å²	95.5	40%	0.399	50%	0.502	S	S	.	.			trans	-64.7	109	178.5	-174.5	0	0	0	0	108.2	Q23	Q23-S25 VanDerWaalsContact C-N 3.33Å; Q23-S25 PolarHBondContact O-N 2.94Å
26	Q	89.7	Confident	72.9	Confident	103 Å²	103	90.3 Å²	90.3	48%	0.481	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	132.9	174.9	-73.7	-171.2	-13	0	0	109.3	I24 V46 S109	I24-Q26 PolarHBondContact O-N 3.25Å; Q26-V46 HydrophobicContact CB-CG1 3.71Å; Q26-V46 HydrophobicContact CG-CG1 4.14Å; Q26-S109 PolarHBondContact O-N 2.92Å
27	V	91.9	Very high	75.6	Confident	0 Å²	0	86.8 Å²	86.8	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	144	179.6	-64.7	0	0	0	0	110.1	F47 M49 V52 L106	V27-F47 WeakPolarHBondContact CG2-O 3.33Å; V27-F47 PolarHBondContact N-O 3.28Å; V27-F47 PolarHBondContact O-N 3.38Å; V27-F47 VanDerWaalsContact O-O 3.08Å; V27-M49 HydrophobicContact CG1-CE 4.42Å; V27-V52 HydrophobicContact CG2-CG2 3.98Å; V27-L106 HydrophobicContact CB-CB 4.35Å; V27-L106 HydrophobicContact CB-CD1 4.44Å; V27-L106 HydrophobicContact CB-CD2 4.23Å; V27-L106 HydrophobicContact CG2-CD1 4.2Å; V27-L106 HydrophobicContact CG2-CD2 3.97Å
28	R	95.1	Very high	78.3	Confident	126 Å²	126	85.8 Å²	85.8	48%	0.475	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	108.2	174.1	-170	171.3	-170.3	-147.9	3.3	109.1	E45 V107	R28-E45 WeakPolarHBondContact CG-O 3.33Å; R28-E45 IonicContact CZ-OE2 3.55Å; R28-E45 IonicContact NE-OE2 3.62Å; R28-E45 IonicContact NH2-OE2 2.7Å; R28-E45 PolarHBondContact NH2-OE2 3.35Å; R28-V107 PolarHBondContact N-O 2.78Å; R28-V107 PolarHBondContact O-N 2.83Å
29	P	95.6	Very high	80.9	Confident	8 Å²	8	77.4 Å²	77.4	5%	0.052	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	142.3	176	-22	33.9	0	0	0	112.8	L33 L34 L37 E45 F47 V52 L106	P29-L33 HydrophobicContact CB-CB 4.17Å; P29-L33 HydrophobicContact CB-CD2 4.06Å; P29-L33 HydrophobicContact CB-CG 4.07Å; P29-L34 HydrophobicContact CB-CB 4.36Å; P29-L37 HydrophobicContact CB-CD1 4.12Å; P29-L37 HydrophobicContact CG-CD1 3.7Å; P29-E45 WeakPolarHBondContact CD-O 3.38Å; P29-F47 HydrophobicContact CG-CD2 3.66Å; P29-F47 HydrophobicContact CG-CE2 4.22Å; P29-V52 HydrophobicContact CG-CG2 4.28Å; P29-L106 HydrophobicContact CB-CD2 3.97Å; P29-L106 HydrophobicContact CG-CD2 3.79Å
30	K	95.7	Very high	83.7	Confident	91 Å²	91	71.1 Å²	71.1	40%	0.396	37%	0.373	S	S	.	.			trans	-63.6	157.3	168.3	-69.5	-175.1	-174.7	171.1	0	110.1	Q32 L33 L34 K104 N105	K30-Q32 VanDerWaalsContact C-N 3.25Å; K30-Q32 PolarHBondContact O-N 3.33Å; K30-Q32 VanDerWaalsContact O-N 3.07Å; K30-L33 PolarHBondContact O-N 3.06Å; K30-L33 VanDerWaalsContact O-N 3.09Å; K30-L34 WeakPolarHBondContact O-CB 3.5Å; K30-L34 PolarHBondContact O-N 3.27Å; K30-K104 VanDerWaalsContact CE-O 3.23Å; K30-K104 WeakPolarHBondContact CE-O 3.31Å; K30-K104 PolarHBondContact NZ-O 2.6Å; K30-N105 WeakPolarHBondContact CG-O 3.22Å; K30-N105 PolarHBondContact N-O 2.72Å
31	L	95.2	Very high	86.2	Confident	116 Å²	116	68.7 Å²	68.7	61%	0.607	36%	0.363	S	S	*	.	H	α-helix	trans	-51.7	-38.5	-172.7	-176.3	63.3	0	0	0	114.3	K35	L31-K35 WeakPolarHBondContact O-CG 3.27Å; L31-K35 PolarHBondContact O-N 3.1Å; L31-K35 VanDerWaalsContact O-N 3.09Å
32	Q	95.1	Very high	88.7	Confident	98 Å²	98	63.8 Å²	63.8	46%	0.458	33%	0.33	S	S	.	.	H	α-helix	trans	-67.1	-48.9	179.9	-65.3	-67.6	-3.7	0	0	112	K30 L34 K35 I36 L84	K30-Q32 VanDerWaalsContact C-N 3.25Å; K30-Q32 PolarHBondContact O-N 3.33Å; K30-Q32 VanDerWaalsContact O-N 3.07Å; Q32-L34 VanDerWaalsContact C-N 3.33Å; Q32-L34 PolarHBondContact O-N 3.41Å; Q32-K35 PolarHBondContact O-N 3.4Å; Q32-I36 PolarHBondContact O-N 3.1Å; Q32-L84 HydrophobicContact CB-CD1 3.73Å
33	L	96.2	Very high	90.9	Very high	0 Å²	0	65 Å²	65	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.8	-41.6	175.3	-177.6	55.3	0	0	0	110.9	P29 K30 K35 I36 L37 V52 L84 M101 L102 N105 L106	P29-L33 HydrophobicContact CB-CB 4.17Å; P29-L33 HydrophobicContact CB-CD2 4.06Å; P29-L33 HydrophobicContact CB-CG 4.07Å; K30-L33 PolarHBondContact O-N 3.06Å; K30-L33 VanDerWaalsContact O-N 3.09Å; L33-K35 VanDerWaalsContact C-N 3.3Å; L33-K35 PolarHBondContact O-N 2.89Å; L33-I36 WeakPolarHBondContact O-CB 3.43Å; L33-I36 PolarHBondContact O-N 3.37Å; L33-L37 HydrophobicContact CD1-CD2 4.49Å; L33-L37 HydrophobicContact CD1-CG 4.4Å; L33-L37 HydrophobicContact CG-CD1 4.22Å; L33-L37 HydrophobicContact CG-CG 4.39Å; L33-L37 WeakPolarHBondContact O-CG 3.49Å; L33-L37 PolarHBondContact O-N 3.08Å; L33-V52 HydrophobicContact CD2-CG1 4.36Å; L33-L84 HydrophobicContact CB-CD2 3.82Å; L33-L84 HydrophobicContact CD1-CD2 3.83Å; L33-L84 HydrophobicContact CG-CD2 4.38Å; L33-M101 HydrophobicContact CD1-CE 4.31Å; L33-M101 HydrophobicContact CD1-SD 4.25Å; L33-M101 HydrophobicContact CD2-SD 4.44Å; L33-L102 HydrophobicContact CD2-CD2 3.87Å; L33-N105 HydrophobicContact CB-CB 4.13Å; L33-N105 HydrophobicContact CD2-CB 3.87Å; L33-L106 HydrophobicContact CD2-CD2 3.77Å; L33-L106 HydrophobicContact CD2-CG 4.28Å
34	L	96.4	Very high	92.7	Very high	21 Å²	21	60.1 Å²	60.1	11%	0.11	32%	0.324	C	S	.	.	H	α-helix	trans	-57.8	-40.9	178.8	-170.8	65.4	0	0	0	112.4	P29 K30 Q32 I36 L37 H38 F47	P29-L34 HydrophobicContact CB-CB 4.36Å; K30-L34 WeakPolarHBondContact O-CB 3.5Å; K30-L34 PolarHBondContact O-N 3.27Å; Q32-L34 VanDerWaalsContact C-N 3.33Å; Q32-L34 PolarHBondContact O-N 3.41Å; L34-I36 VanDerWaalsContact C-N 3.31Å; L34-I36 PolarHBondContact O-N 3.35Å; L34-L37 PolarHBondContact O-N 2.98Å; L34-H38 PolarHBondContact O-N 2.89Å; L34-F47 HydrophobicContact CD1-CE2 3.56Å; L34-F47 HydrophobicContact CD1-CZ 4.21Å
35	K	96.9	Very high	94.1	Very high	103 Å²	103	60.1 Å²	60.1	45%	0.448	32%	0.321	S	S	.	.	H	α-helix	trans	-60.3	-40.2	175.2	-75.3	172.2	179.6	-179.5	0	112.6	L31 Q32 L33 A39	L31-K35 WeakPolarHBondContact O-CG 3.27Å; L31-K35 PolarHBondContact O-N 3.1Å; L31-K35 VanDerWaalsContact O-N 3.09Å; Q32-K35 PolarHBondContact O-N 3.4Å; L33-K35 VanDerWaalsContact C-N 3.3Å; L33-K35 PolarHBondContact O-N 2.89Å; K35-A39 VanDerWaalsContact O-CB 3.31Å; K35-A39 WeakPolarHBondContact O-CB 3.44Å; K35-A39 PolarHBondContact O-N 3.19Å
36	I	96.9	Very high	94.9	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-47	176.7	-65	172.7	0	0	0	109.5	Q32 L33 L34 H38 A39 A40 L56 Y59 L80 L81 L84	Q32-I36 PolarHBondContact O-N 3.1Å; L33-I36 WeakPolarHBondContact O-CB 3.43Å; L33-I36 PolarHBondContact O-N 3.37Å; L34-I36 VanDerWaalsContact C-N 3.31Å; L34-I36 PolarHBondContact O-N 3.35Å; I36-H38 PolarHBondContact O-N 3.3Å; I36-A39 PolarHBondContact O-N 3.19Å; I36-A40 PolarHBondContact O-N 2.88Å; I36-A40 VanDerWaalsContact O-N 3.08Å; I36-L56 HydrophobicContact CG2-CD1 4.11Å; I36-Y59 HydrophobicContact CB-CD2 4.45Å; I36-Y59 HydrophobicContact CB-CE2 4.33Å; I36-Y59 HydrophobicContact CG2-CD1 3.71Å; I36-Y59 HydrophobicContact CG2-CD2 3.62Å; I36-Y59 HydrophobicContact CG2-CE1 3.9Å; I36-Y59 HydrophobicContact CG2-CE2 3.82Å; I36-Y59 HydrophobicContact CG2-CG 3.54Å; I36-Y59 VanDerWaalsContact O-CD2 3.28Å; I36-Y59 WeakPolarHBondContact O-CD2 3.41Å; I36-L80 HydrophobicContact CD1-CB 4.2Å; I36-L80 HydrophobicContact CG1-CB 4.09Å; I36-L81 HydrophobicContact CD1-CB 4.29Å; I36-L81 HydrophobicContact CD1-CD1 4.33Å; I36-L84 HydrophobicContact CD1-CB 4.35Å; I36-L84 HydrophobicContact CD1-CD2 3.76Å
37	L	97	Very high	95.1	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.3	-43.9	178.7	-58.3	174.7	0	0	0	111.5	P29 L33 L34 A39 A40 G41 A42 F47 V52	P29-L37 HydrophobicContact CB-CD1 4.12Å; P29-L37 HydrophobicContact CG-CD1 3.7Å; L33-L37 HydrophobicContact CD1-CD2 4.49Å; L33-L37 HydrophobicContact CD1-CG 4.4Å; L33-L37 HydrophobicContact CG-CD1 4.22Å; L33-L37 HydrophobicContact CG-CG 4.39Å; L33-L37 WeakPolarHBondContact O-CG 3.49Å; L33-L37 PolarHBondContact O-N 3.08Å; L34-L37 PolarHBondContact O-N 2.98Å; L37-A39 PolarHBondContact O-N 3.45Å; L37-A40 CarbonylContact O-C 3.57Å; L37-A40 WeakPolarHBondContact O-CA 3.44Å; L37-A40 VanDerWaalsContact O-CB 3.25Å; L37-A40 WeakPolarHBondContact O-CB 3.15Å; L37-A40 PolarHBondContact O-N 2.84Å; L37-G41 PolarHBondContact O-N 2.8Å; L37-A42 VanDerWaalsContact C-CB 3.48Å; L37-A42 HydrophobicContact CB-CB 3.85Å; L37-A42 WeakPolarHBondContact O-CB 3.37Å; L37-A42 PolarHBondContact O-N 3.33Å; L37-F47 HydrophobicContact CD1-CD2 4.35Å; L37-F47 HydrophobicContact CD1-CE2 4.37Å; L37-V52 HydrophobicContact CD1-CG1 4.44Å; L37-V52 HydrophobicContact CD1-CG2 4.3Å; L37-V52 HydrophobicContact CD2-CG1 4.34Å; L37-V52 WeakPolarHBondContact CD2-O 3.28Å
38	H	96.5	Very high	95	Very high	86 Å²	86	57.2 Å²	57.2	40%	0.398	31%	0.308	S	S	.	.	H	α-helix	trans	-64.1	-39.4	175.9	-71.5	176.4	0	0	0	112.4	L34 I36 A40 G41 A42 G44	L34-H38 PolarHBondContact O-N 2.89Å; I36-H38 PolarHBondContact O-N 3.3Å; H38-A40 PolarHBondContact O-N 2.98Å; H38-G41 PolarHBondContact O-N 2.98Å; H38-A42 PolarHBondContact CD2-O 2.96Å; H38-G44 PolarHBondContact NE2-O 3.27Å
39	A	96.1	Very high	94.6	Very high	67 Å²	67	52 Å²	52	55%	0.554	29%	0.289	S	S	*	.	H	α-helix	trans	-62.9	-23.9	173.3	0	0	0	0	0	112.5	K35 I36 L37 G41 Y59	K35-A39 VanDerWaalsContact O-CB 3.31Å; K35-A39 WeakPolarHBondContact O-CB 3.44Å; K35-A39 PolarHBondContact O-N 3.19Å; I36-A39 PolarHBondContact O-N 3.19Å; L37-A39 PolarHBondContact O-N 3.45Å; A39-G41 VanDerWaalsContact C-N 3.32Å; A39-Y59 HydrophobicContact CB-CD2 4.03Å; A39-Y59 HydrophobicContact CB-CE2 3.8Å
40	A	95.2	Very high	94.2	Very high	14 Å²	14	58 Å²	58	12%	0.116	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-4.9	172.5	0	0	0	0	0	114	I36 L37 H38 Y55 Q58 Y59	I36-A40 PolarHBondContact O-N 2.88Å; I36-A40 VanDerWaalsContact O-N 3.08Å; L37-A40 CarbonylContact O-C 3.57Å; L37-A40 WeakPolarHBondContact O-CA 3.44Å; L37-A40 VanDerWaalsContact O-CB 3.25Å; L37-A40 WeakPolarHBondContact O-CB 3.15Å; L37-A40 PolarHBondContact O-N 2.84Å; H38-A40 PolarHBondContact O-N 2.98Å; A40-Y55 HydrophobicContact CB-CD1 4.44Å; A40-Y55 WeakPolarHBondContact CB-O 3.25Å; A40-Q58 HydrophobicContact CB-CB 4.25Å; A40-Q58 HydrophobicContact CB-CG 4.38Å; A40-Y59 HydrophobicContact CB-CD2 4.49Å
41	G	93.7	Very high	94	Very high	45 Å²	45	57.4 Å²	57.4	46%	0.464	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.6	5.5	-177.7	0	0	0	0	0	115.1	L37 H38 A39	L37-G41 PolarHBondContact O-N 2.8Å; H38-G41 PolarHBondContact O-N 2.98Å; A39-G41 VanDerWaalsContact C-N 3.32Å
42	A	95.6	Very high	93.9	Very high	6 Å²	6	51.9 Å²	51.9	5%	0.05	28%	0.284	C	S	.	.			trans	-66.1	145.6	175.7	0	0	0	0	0	111.6	L37 H38 F47 Y55	L37-A42 VanDerWaalsContact C-CB 3.48Å; L37-A42 HydrophobicContact CB-CB 3.85Å; L37-A42 WeakPolarHBondContact O-CB 3.37Å; L37-A42 PolarHBondContact O-N 3.33Å; H38-A42 PolarHBondContact CD2-O 2.96Å; A42-F47 HydrophobicContact CB-CE1 3.81Å; A42-F47 HydrophobicContact CB-CZ 3.99Å; A42-Y55 HydrophobicContact CB-CD1 3.73Å; A42-Y55 HydrophobicContact CB-CD2 3.57Å; A42-Y55 HydrophobicContact CB-CE1 3.79Å; A42-Y55 HydrophobicContact CB-CE2 3.65Å; A42-Y55 HydrophobicContact CB-CG 3.63Å
43	Q	94	Very high	93.6	Very high	171 Å²	171	47.4 Å²	47.4	80%	0.799	26%	0.263	S	S	*	.			trans	-125.9	143.2	176.5	-62.6	174.3	20.4	0	0	109.5
44	G	92.8	Very high	93.4	Very high	43 Å²	43	51.2 Å²	51.2	44%	0.443	28%	0.281	S	S	.	.	S	Bend	trans	97.5	-178	-176.9	0	0	0	0	0	113.7	H38 F47	H38-G44 PolarHBondContact NE2-O 3.27Å; G44-F47 WeakPolarHBondContact O-CZ 3.39Å
45	E	93.7	Very high	93.3	Very high	105 Å²	105	52.8 Å²	52.8	49%	0.491	29%	0.286	S	S	.	.	S	Bend	trans	-119	-14.7	-177.3	-61.3	-172.8	-178.9	0	0	113.2	R28 P29	R28-E45 WeakPolarHBondContact CG-O 3.33Å; R28-E45 IonicContact CZ-OE2 3.55Å; R28-E45 IonicContact NE-OE2 3.62Å; R28-E45 IonicContact NH2-OE2 2.7Å; R28-E45 PolarHBondContact NH2-OE2 3.35Å; P29-E45 WeakPolarHBondContact CD-O 3.38Å
46	V	93.8	Very high	93.1	Very high	62 Å²	62	48 Å²	48	38%	0.376	27%	0.265	S	S	.	.			trans	-119.6	133.8	-177.5	-178.9	0	0	0	0	107.7	Q26	Q26-V46 HydrophobicContact CB-CG1 3.71Å; Q26-V46 HydrophobicContact CG-CG1 4.14Å
47	F	92.8	Very high	92.9	Very high	5 Å²	5	47.9 Å²	47.9	2%	0.022	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	158.3	-175.6	-60.9	-85	0	0	0	109.7	V27 P29 L34 L37 A42 G44 E51 V52 Y55	V27-F47 WeakPolarHBondContact CG2-O 3.33Å; V27-F47 PolarHBondContact N-O 3.28Å; V27-F47 PolarHBondContact O-N 3.38Å; V27-F47 VanDerWaalsContact O-O 3.08Å; P29-F47 HydrophobicContact CG-CD2 3.66Å; P29-F47 HydrophobicContact CG-CE2 4.22Å; L34-F47 HydrophobicContact CD1-CE2 3.56Å; L34-F47 HydrophobicContact CD1-CZ 4.21Å; L37-F47 HydrophobicContact CD1-CD2 4.35Å; L37-F47 HydrophobicContact CD1-CE2 4.37Å; A42-F47 HydrophobicContact CB-CE1 3.81Å; A42-F47 HydrophobicContact CB-CZ 3.99Å; G44-F47 WeakPolarHBondContact O-CZ 3.39Å; F47-E51 HydrophobicContact CB-CB 4.24Å; F47-E51 HydrophobicContact CD1-CB 4.2Å; F47-V52 HydrophobicContact CB-CG2 3.69Å; F47-V52 HydrophobicContact CG-CG2 4.38Å; F47-Y55 HydrophobicContact CD1-CD2 4.42Å; F47-Y55 HydrophobicContact CD1-CE2 4.22Å; F47-Y55 HydrophobicContact CE1-CD2 4.41Å; F47-Y55 HydrophobicContact CE1-CE2 4.12Å
48	T	91.1	Very high	92.7	Very high	32 Å²	32	50.5 Å²	50.5	20%	0.196	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	157.8	160.9	64.6	0	0	0	0	109.4	I24 K50 E51 V52	I24-T48 HydrophobicContact CG2-CG2 3.34Å; T48-K50 PolarHBondContact O-N 2.91Å; T48-E51 WeakPolarHBondContact CG2-OE2 3.23Å; T48-E51 PolarHBondContact N-OE2 3.42Å; T48-E51 PolarHBondContact O-N 3.13Å; T48-E51 VanDerWaalsContact O-N 3.13Å; T48-E51 WeakPolarHBondContact OG1-CB 3.16Å; T48-E51 VanDerWaalsContact OG1-CG 3.25Å; T48-E51 WeakPolarHBondContact OG1-CG 3.48Å; T48-E51 PolarHBondContact OG1-N 2.94Å; T48-E51 VanDerWaalsContact OG1-N 3.16Å; T48-E51 PolarHBondContact OG1-OE2 3.06Å; T48-V52 WeakPolarHBondContact O-CG2 3.25Å; T48-V52 PolarHBondContact O-N 3.45Å
49	M	87.4	Confident	92.6	Very high	16 Å²	16	46.6 Å²	46.6	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-36.4	175.3	-166.9	63.7	73.6	0	0	111.8	V27 E51 V52 M53 L102 L106 L188 F190 W193	V27-M49 HydrophobicContact CG1-CE 4.42Å; M49-E51 VanDerWaalsContact C-N 3.33Å; M49-E51 PolarHBondContact O-N 3.5Å; M49-V52 PolarHBondContact O-N 3.24Å; M49-M53 HydrophobicContact CG-CG 4.46Å; M49-M53 WeakPolarHBondContact O-CB 3.2Å; M49-M53 VanDerWaalsContact O-CG 3.26Å; M49-M53 WeakPolarHBondContact O-CG 3.45Å; M49-M53 PolarHBondContact O-N 2.62Å; M49-L102 HydrophobicContact SD-CD1 4.03Å; M49-L106 HydrophobicContact CE-CD1 3.3Å; M49-L106 HydrophobicContact SD-CD1 3.5Å; M49-L106 WeakPolarHBondContact SD-CD1 3.46Å; M49-L188 HydrophobicContact CE-CD1 3.34Å; M49-L188 HydrophobicContact CE-CD2 3.35Å; M49-L188 HydrophobicContact CE-CG 3.9Å; M49-F190 HydrophobicContact CE-CE1 4.21Å; M49-F190 HydrophobicContact CE-CZ 4.45Å; M49-W193 HydrophobicContact CB-CH2 3.78Å; M49-W193 HydrophobicContact CB-CZ2 3.85Å; M49-W193 HydrophobicContact CG-CH2 3.29Å; M49-W193 HydrophobicContact CG-CZ2 3.24Å
50	K	87	Confident	92.5	Very high	136 Å²	136	44 Å²	44	59%	0.591	24%	0.235	S	C	*	.	H	α-helix	trans	-58.9	-43.7	176.3	-175.9	177	180	176	0	111.9	T48 H54	T48-K50 PolarHBondContact O-N 2.91Å; K50-H54 WeakPolarHBondContact O-CB 3.49Å; K50-H54 PolarHBondContact O-N 2.89Å
51	E	91.4	Very high	92.3	Very high	78 Å²	78	45.8 Å²	45.8	36%	0.364	24%	0.242	S	C	.	.	H	α-helix	trans	-66.9	-44.6	175.8	-73.4	165	140.5	0	0	111.8	F47 T48 M49 M53 H54 Y55	F47-E51 HydrophobicContact CB-CB 4.24Å; F47-E51 HydrophobicContact CD1-CB 4.2Å; T48-E51 WeakPolarHBondContact CG2-OE2 3.23Å; T48-E51 PolarHBondContact N-OE2 3.42Å; T48-E51 PolarHBondContact O-N 3.13Å; T48-E51 VanDerWaalsContact O-N 3.13Å; T48-E51 WeakPolarHBondContact OG1-CB 3.16Å; T48-E51 VanDerWaalsContact OG1-CG 3.25Å; T48-E51 WeakPolarHBondContact OG1-CG 3.48Å; T48-E51 PolarHBondContact OG1-N 2.94Å; T48-E51 VanDerWaalsContact OG1-N 3.16Å; T48-E51 PolarHBondContact OG1-OE2 3.06Å; M49-E51 VanDerWaalsContact C-N 3.33Å; M49-E51 PolarHBondContact O-N 3.5Å; E51-M53 VanDerWaalsContact C-N 3.25Å; E51-M53 PolarHBondContact O-N 3.26Å; E51-H54 WeakPolarHBondContact O-CB 3.18Å; E51-H54 PolarHBondContact O-N 2.86Å; E51-Y55 HydrophobicContact CB-CD2 4.28Å; E51-Y55 HydrophobicContact CB-CE2 4.15Å; E51-Y55 WeakPolarHBondContact O-CD2 3.33Å; E51-Y55 PolarHBondContact O-N 3.47Å
52	V	92	Very high	92.2	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-54.6	-47.8	176.7	173.3	0	0	0	0	110.2	V27 P29 L33 L37 F47 T48 M49 L56 L102 L106	V27-V52 HydrophobicContact CG2-CG2 3.98Å; P29-V52 HydrophobicContact CG-CG2 4.28Å; L33-V52 HydrophobicContact CD2-CG1 4.36Å; L37-V52 HydrophobicContact CD1-CG1 4.44Å; L37-V52 HydrophobicContact CD1-CG2 4.3Å; L37-V52 HydrophobicContact CD2-CG1 4.34Å; L37-V52 WeakPolarHBondContact CD2-O 3.28Å; F47-V52 HydrophobicContact CB-CG2 3.69Å; F47-V52 HydrophobicContact CG-CG2 4.38Å; T48-V52 WeakPolarHBondContact O-CG2 3.25Å; T48-V52 PolarHBondContact O-N 3.45Å; M49-V52 PolarHBondContact O-N 3.24Å; V52-L56 VanDerWaalsContact O-CB 3.28Å; V52-L56 WeakPolarHBondContact O-CB 3.1Å; V52-L56 PolarHBondContact O-N 3.34Å; V52-L102 HydrophobicContact CG1-CD2 3.63Å; V52-L106 HydrophobicContact CG2-CD2 4.25Å
53	M	90.1	Very high	92.1	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-51	178.3	-69.4	-69.4	-108.4	0	0	111.2	M49 E51 Y55 L56 G57 L98 Y99 L102 W193 W201 F202	M49-M53 HydrophobicContact CG-CG 4.46Å; M49-M53 WeakPolarHBondContact O-CB 3.2Å; M49-M53 VanDerWaalsContact O-CG 3.26Å; M49-M53 WeakPolarHBondContact O-CG 3.45Å; M49-M53 PolarHBondContact O-N 2.62Å; E51-M53 VanDerWaalsContact C-N 3.25Å; E51-M53 PolarHBondContact O-N 3.26Å; M53-Y55 VanDerWaalsContact C-N 3.35Å; M53-Y55 PolarHBondContact O-N 2.94Å; M53-L56 WeakPolarHBondContact O-CB 3.28Å; M53-L56 PolarHBondContact O-N 3.19Å; M53-G57 PolarHBondContact O-N 2.96Å; M53-G57 VanDerWaalsContact O-N 3.13Å; M53-L98 HydrophobicContact CE-CD2 3.83Å; M53-L98 HydrophobicContact SD-CD2 3.57Å; M53-L98 VanDerWaalsContact SD-CD2 3.57Å; M53-Y99 HydrophobicContact CE-CD1 4.39Å; M53-Y99 HydrophobicContact CE-CE1 3.55Å; M53-L102 HydrophobicContact CE-CD1 4.43Å; M53-L102 HydrophobicContact SD-CD1 3.64Å; M53-W193 HydrophobicContact CB-CH2 4.49Å; M53-W193 HydrophobicContact CB-CZ3 4.01Å; M53-W193 HydrophobicContact CE-CE3 4.05Å; M53-W193 HydrophobicContact CE-CZ3 4.07Å; M53-W193 HydrophobicContact CG-CE3 4.41Å; M53-W193 HydrophobicContact CG-CH2 3.74Å; M53-W193 HydrophobicContact CG-CZ3 3.55Å; M53-W201 WeakPolarHBondContact O-CH2 3.35Å; M53-F202 HydrophobicContact CE-CE2 3.3Å; M53-F202 HydrophobicContact CE-CZ 3.55Å; M53-F202 HydrophobicContact SD-CE2 4.33Å
54	H	90	Very high	92	Very high	81 Å²	81	50.1 Å²	50.1	38%	0.375	25%	0.253	S	S	.	.	H	α-helix	trans	-51.4	-51.1	178	174.1	77.5	0	0	0	112.6	K50 E51 L56 G57 Q58 W201	K50-H54 WeakPolarHBondContact O-CB 3.49Å; K50-H54 PolarHBondContact O-N 2.89Å; E51-H54 WeakPolarHBondContact O-CB 3.18Å; E51-H54 PolarHBondContact O-N 2.86Å; H54-L56 VanDerWaalsContact C-N 3.33Å; H54-L56 PolarHBondContact O-N 3.12Å; H54-G57 PolarHBondContact O-N 3.09Å; H54-Q58 WeakPolarHBondContact O-CB 3.34Å; H54-Q58 PolarHBondContact O-N 3.06Å; H54-W201 WeakPolarHBondContact O-CZ2 3.37Å
55	Y	94.8	Very high	92.1	Very high	53 Å²	53	49.2 Å²	49.2	21%	0.208	24%	0.238	C	C	.	.	H	α-helix	trans	-69	-31.4	179.2	-71.3	-61.5	0	0	0	112.5	A40 A42 F47 E51 M53 Q58 Y59	A40-Y55 HydrophobicContact CB-CD1 4.44Å; A40-Y55 WeakPolarHBondContact CB-O 3.25Å; A42-Y55 HydrophobicContact CB-CD1 3.73Å; A42-Y55 HydrophobicContact CB-CD2 3.57Å; A42-Y55 HydrophobicContact CB-CE1 3.79Å; A42-Y55 HydrophobicContact CB-CE2 3.65Å; A42-Y55 HydrophobicContact CB-CG 3.63Å; F47-Y55 HydrophobicContact CD1-CD2 4.42Å; F47-Y55 HydrophobicContact CD1-CE2 4.22Å; F47-Y55 HydrophobicContact CE1-CD2 4.41Å; F47-Y55 HydrophobicContact CE1-CE2 4.12Å; E51-Y55 HydrophobicContact CB-CD2 4.28Å; E51-Y55 HydrophobicContact CB-CE2 4.15Å; E51-Y55 WeakPolarHBondContact O-CD2 3.33Å; E51-Y55 PolarHBondContact O-N 3.47Å; M53-Y55 VanDerWaalsContact C-N 3.35Å; M53-Y55 PolarHBondContact O-N 2.94Å; Y55-Q58 PolarHBondContact O-N 2.92Å; Y55-Y59 WeakPolarHBondContact O-CB 3.34Å; Y55-Y59 PolarHBondContact O-N 3.09Å
56	L	93.9	Very high	92	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-42	177.4	-170.5	60.3	0	0	0	112.1	I36 V52 M53 H54 Y59 I60 L81 L98 M101	I36-L56 HydrophobicContact CG2-CD1 4.11Å; V52-L56 VanDerWaalsContact O-CB 3.28Å; V52-L56 WeakPolarHBondContact O-CB 3.1Å; V52-L56 PolarHBondContact O-N 3.34Å; M53-L56 WeakPolarHBondContact O-CB 3.28Å; M53-L56 PolarHBondContact O-N 3.19Å; H54-L56 VanDerWaalsContact C-N 3.33Å; H54-L56 PolarHBondContact O-N 3.12Å; L56-Y59 WeakPolarHBondContact O-CB 3.36Å; L56-Y59 PolarHBondContact O-N 3.34Å; L56-I60 WeakPolarHBondContact O-CG1 3.42Å; L56-I60 PolarHBondContact O-N 3.47Å; L56-L81 HydrophobicContact CD1-CD1 3.63Å; L56-L98 HydrophobicContact CD2-CD1 3.65Å; L56-L98 HydrophobicContact CD2-CD2 4.09Å; L56-L98 HydrophobicContact CD2-CG 3.83Å; L56-M101 HydrophobicContact CD2-CE 4.02Å
57	G	92.1	Very high	92	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-82.3	-23.6	174.1	0	0	0	0	0	114.6	M53 H54 Y59 I60 M61 W201	M53-G57 PolarHBondContact O-N 2.96Å; M53-G57 VanDerWaalsContact O-N 3.13Å; H54-G57 PolarHBondContact O-N 3.09Å; G57-Y59 PolarHBondContact O-N 3Å; G57-I60 PolarHBondContact O-N 3.48Å; G57-M61 WeakPolarHBondContact O-CB 3.13Å; G57-M61 PolarHBondContact O-N 3.3Å; G57-W201 VanDerWaalsContact C-CE2 3.5Å
58	Q	92.5	Very high	91.7	Very high	55 Å²	55	52.3 Å²	52.3	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-58.2	-41.7	164.8	-172.6	64.7	34.8	0	0	110.6	A40 H54 Y55 M61 V62	A40-Q58 HydrophobicContact CB-CB 4.25Å; A40-Q58 HydrophobicContact CB-CG 4.38Å; H54-Q58 WeakPolarHBondContact O-CB 3.34Å; H54-Q58 PolarHBondContact O-N 3.06Å; Y55-Q58 PolarHBondContact O-N 2.92Å; Q58-M61 VanDerWaalsContact CD-CE 3.4Å; Q58-M61 PolarHBondContact O-N 3.19Å; Q58-V62 HydrophobicContact CG-CG2 4.38Å; Q58-V62 WeakPolarHBondContact O-CB 3.39Å; Q58-V62 VanDerWaalsContact O-CG2 3.28Å; Q58-V62 WeakPolarHBondContact O-CG2 3.45Å; Q58-V62 PolarHBondContact O-N 3.13Å
59	Y	95.4	Very high	91.5	Very high	3 Å²	3	59.4 Å²	59.4	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-60.2	-49.5	174.8	-176.8	-94.1	0	0	0	112	I36 A39 A40 Y55 L56 G57 M61 V62 K63 L65 D79 L81	I36-Y59 HydrophobicContact CB-CD2 4.45Å; I36-Y59 HydrophobicContact CB-CE2 4.33Å; I36-Y59 HydrophobicContact CG2-CD1 3.71Å; I36-Y59 HydrophobicContact CG2-CD2 3.62Å; I36-Y59 HydrophobicContact CG2-CE1 3.9Å; I36-Y59 HydrophobicContact CG2-CE2 3.82Å; I36-Y59 HydrophobicContact CG2-CG 3.54Å; I36-Y59 VanDerWaalsContact O-CD2 3.28Å; I36-Y59 WeakPolarHBondContact O-CD2 3.41Å; A39-Y59 HydrophobicContact CB-CD2 4.03Å; A39-Y59 HydrophobicContact CB-CE2 3.8Å; A40-Y59 HydrophobicContact CB-CD2 4.49Å; Y55-Y59 WeakPolarHBondContact O-CB 3.34Å; Y55-Y59 PolarHBondContact O-N 3.09Å; L56-Y59 WeakPolarHBondContact O-CB 3.36Å; L56-Y59 PolarHBondContact O-N 3.34Å; G57-Y59 PolarHBondContact O-N 3Å; Y59-M61 VanDerWaalsContact C-N 3.28Å; Y59-M61 PolarHBondContact O-N 3.42Å; Y59-V62 PolarHBondContact O-N 2.73Å; Y59-K63 HydrophobicContact CE1-CD 3.84Å; Y59-K63 HydrophobicContact CE2-CD 3.99Å; Y59-K63 WeakPolarHBondContact O-CB 3.36Å; Y59-K63 PolarHBondContact O-N 2.97Å; Y59-K63 WeakPolarHBondContact OH-CE 3.34Å; Y59-K63 PolarHBondContact OH-NZ 2.81Å; Y59-L65 HydrophobicContact CD1-CD1 4.28Å; Y59-L65 HydrophobicContact CE1-CD1 3.96Å; Y59-D79 WeakPolarHBondContact CE1-OD1 3.4Å; Y59-D79 VanDerWaalsContact CZ-OD1 3.31Å; Y59-D79 VanDerWaalsContact OH-CG 3.25Å; Y59-D79 PolarHBondContact OH-OD1 2.87Å; Y59-D79 PolarHBondContact OH-OD2 3.34Å; Y59-D79 VanDerWaalsContact OH-OD2 3.1Å; Y59-L81 HydrophobicContact CD1-CB 4.43Å; Y59-L81 HydrophobicContact CD1-CD2 4.14Å; Y59-L81 HydrophobicContact CE1-CB 3.83Å; Y59-L81 HydrophobicContact CE1-CD2 4.29Å
60	I	93.6	Very high	91.5	Very high	12 Å²	12	63.6 Å²	63.6	6%	0.062	30%	0.299	C	S	.	.	H	α-helix	trans	-57.8	-42.5	177.3	-68.9	165.9	0	0	0	110.9	L56 G57 Q64 L65 Y66 V74 L81 F90	L56-I60 WeakPolarHBondContact O-CG1 3.42Å; L56-I60 PolarHBondContact O-N 3.47Å; G57-I60 PolarHBondContact O-N 3.48Å; I60-Q64 WeakPolarHBondContact O-CA 3.41Å; I60-Q64 PolarHBondContact O-N 3.33Å; I60-L65 HydrophobicContact CG2-CB 4.24Å; I60-L65 PolarHBondContact O-N 3.48Å; I60-Y66 HydrophobicContact CG2-CD1 4.4Å; I60-V74 HydrophobicContact CD1-CG1 4.25Å; I60-V74 HydrophobicContact CD1-CG2 4.43Å; I60-V74 HydrophobicContact CG1-CG1 4.25Å; I60-V74 HydrophobicContact CG2-CG1 4.03Å; I60-V74 HydrophobicContact CG2-CG2 4.06Å; I60-L81 HydrophobicContact CD1-CD2 4.03Å; I60-L81 HydrophobicContact CG1-CD2 3.62Å; I60-F90 HydrophobicContact CD1-CZ 4.03Å
61	M	90.3	Very high	91.4	Very high	53 Å²	53	58.7 Å²	58.7	26%	0.261	28%	0.278	S	S	.	.	H	α-helix	trans	-68	-49	-179.9	-176.2	177.4	62.8	0	0	112	G57 Q58 Y59 K63 Q64 W200	G57-M61 WeakPolarHBondContact O-CB 3.13Å; G57-M61 PolarHBondContact O-N 3.3Å; Q58-M61 VanDerWaalsContact CD-CE 3.4Å; Q58-M61 PolarHBondContact O-N 3.19Å; Y59-M61 VanDerWaalsContact C-N 3.28Å; Y59-M61 PolarHBondContact O-N 3.42Å; M61-K63 VanDerWaalsContact C-N 3.3Å; M61-K63 PolarHBondContact O-N 2.91Å; M61-Q64 PolarHBondContact O-N 3.44Å; M61-Q64 VanDerWaalsContact O-N 3.1Å; M61-W200 HydrophobicContact CG-CZ2 4.13Å; M61-W200 HydrophobicContact SD-CZ2 3.63Å
62	V	91	Very high	91.2	Very high	91 Å²	91	56.5 Å²	56.5	55%	0.552	27%	0.268	S	S	*	.	H	α-helix	trans	-63.6	-38	-179.4	170.3	0	0	0	0	111.2	Q58 Y59 Q64	Q58-V62 HydrophobicContact CG-CG2 4.38Å; Q58-V62 WeakPolarHBondContact O-CB 3.39Å; Q58-V62 VanDerWaalsContact O-CG2 3.28Å; Q58-V62 WeakPolarHBondContact O-CG2 3.45Å; Q58-V62 PolarHBondContact O-N 3.13Å; Y59-V62 PolarHBondContact O-N 2.73Å; V62-Q64 VanDerWaalsContact C-N 3.32Å
63	K	94	Very high	91.2	Very high	93 Å²	93	58.3 Å²	58.3	40%	0.404	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-4	176	-76.2	-160	162.9	-178.6	0	114.7	Y59 M61 L65 D79	Y59-K63 HydrophobicContact CE1-CD 3.84Å; Y59-K63 HydrophobicContact CE2-CD 3.99Å; Y59-K63 WeakPolarHBondContact O-CB 3.36Å; Y59-K63 PolarHBondContact O-N 2.97Å; Y59-K63 WeakPolarHBondContact OH-CE 3.34Å; Y59-K63 PolarHBondContact OH-NZ 2.81Å; M61-K63 VanDerWaalsContact C-N 3.3Å; M61-K63 PolarHBondContact O-N 2.91Å; K63-L65 HydrophobicContact CB-CD1 4.16Å; K63-L65 HydrophobicContact CB-CD2 4.03Å; K63-L65 HydrophobicContact CB-CG 3.68Å; K63-L65 PolarHBondContact O-N 2.73Å; K63-D79 VanDerWaalsContact CD-OD2 3.27Å; K63-D79 WeakPolarHBondContact CD-OD2 3.32Å; K63-D79 WeakPolarHBondContact CE-OD2 3.37Å; K63-D79 IonicContact NZ-OD2 3.25Å; K63-D79 PolarHBondContact NZ-OD2 2.98Å
64	Q	92.7	Very high	91.4	Very high	128 Å²	128	58.2 Å²	58.2	60%	0.598	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	42.9	-176.7	-56.7	-178.8	30.9	0	0	112.4	I60 M61 V62 Y66	I60-Q64 WeakPolarHBondContact O-CA 3.41Å; I60-Q64 PolarHBondContact O-N 3.33Å; M61-Q64 PolarHBondContact O-N 3.44Å; M61-Q64 VanDerWaalsContact O-N 3.1Å; V62-Q64 VanDerWaalsContact C-N 3.32Å; Q64-Y66 HydrophobicContact CB-CE1 4.43Å; Q64-Y66 PolarHBondContact O-N 3.11Å
65	L	94.1	Very high	91.7	Very high	24 Å²	24	59.6 Å²	59.6	13%	0.126	28%	0.279	C	S	.	.			trans	-75.8	-4.6	179.5	-59.7	178.6	0	0	0	112.4	Y59 I60 K63 V74 Y75 C76 D79 L81	Y59-L65 HydrophobicContact CD1-CD1 4.28Å; Y59-L65 HydrophobicContact CE1-CD1 3.96Å; I60-L65 HydrophobicContact CG2-CB 4.24Å; I60-L65 PolarHBondContact O-N 3.48Å; K63-L65 HydrophobicContact CB-CD1 4.16Å; K63-L65 HydrophobicContact CB-CD2 4.03Å; K63-L65 HydrophobicContact CB-CG 3.68Å; K63-L65 PolarHBondContact O-N 2.73Å; L65-V74 HydrophobicContact CB-CG1 3.9Å; L65-V74 CarbonylContact O-C 3.46Å; L65-V74 WeakPolarHBondContact O-CA 3.07Å; L65-Y75 PolarHBondContact O-N 3.02Å; L65-C76 HydrophobicContact CD1-CB 4.46Å; L65-D79 HydrophobicContact CD1-CB 4.43Å; L65-D79 HydrophobicContact CD2-CB 4.46Å; L65-L81 HydrophobicContact CD1-CD2 4.09Å
66	Y	92.9	Very high	91.7	Very high	55 Å²	55	57.1 Å²	57.1	22%	0.216	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-88.7	152.3	179.2	63.6	-89.1	0	0	0	111.6	I60 Q64 Q71 M73	I60-Y66 HydrophobicContact CG2-CD1 4.4Å; Q64-Y66 HydrophobicContact CB-CE1 4.43Å; Q64-Y66 PolarHBondContact O-N 3.11Å; Y66-Q71 HydrophobicContact CD2-CB 4.42Å; Y66-Q71 HydrophobicContact CD2-CG 3.94Å; Y66-Q71 HydrophobicContact CE2-CG 4.25Å; Y66-M73 CarbonylContact C-O 3.49Å; Y66-M73 WeakPolarHBondContact CA-O 3.26Å
67	D	92.1	Very high	91.7	Very high	42 Å²	42	58.2 Å²	58.2	23%	0.225	28%	0.281	C	S	.	.			trans	-73.9	135.5	173.4	-167.1	-89.4	0	0	0	111.4	Q69 E70 Q71 M73 Y75	D67-Q69 VanDerWaalsContact C-N 3.34Å; D67-Q69 PolarHBondContact O-N 3.07Å; D67-Q69 WeakPolarHBondContact OD1-CA 3.5Å; D67-Q69 WeakPolarHBondContact OD1-CB 3.04Å; D67-Q69 PolarHBondContact OD1-N 3.31Å; D67-E70 HydrophobicContact CB-CB 4.35Å; D67-E70 CarbonylContact O-C 3.59Å; D67-E70 PolarHBondContact OD1-N 3.39Å; D67-Q71 WeakPolarHBondContact O-CA 3.44Å; D67-Q71 VanDerWaalsContact O-CG 3.25Å; D67-Q71 WeakPolarHBondContact O-CG 3.38Å; D67-Q71 PolarHBondContact O-N 3.09Å; D67-M73 HydrophobicContact CB-CB 4.19Å; D67-M73 PolarHBondContact N-O 2.7Å; D67-Y75 HydrophobicContact CB-CD2 4.34Å; D67-Y75 HydrophobicContact CB-CE2 3.81Å
68	Q	87.6	Confident	91.8	Very high	140 Å²	140	62.2 Å²	62.2	65%	0.654	32%	0.322	S	S	*	.	S	Bend	trans	-71.2	-28.4	-178	-67.5	-177.8	-3.3	0	0	113.4
69	Q	86.9	Confident	92	Very high	181 Å²	181	60.4 Å²	60.4	85%	0.846	31%	0.314	S	S	*	.	S	Bend	trans	-88.8	-46.6	178.9	-57.1	-175.2	1.5	0	0	110.2	D67	D67-Q69 VanDerWaalsContact C-N 3.34Å; D67-Q69 PolarHBondContact O-N 3.07Å; D67-Q69 WeakPolarHBondContact OD1-CA 3.5Å; D67-Q69 WeakPolarHBondContact OD1-CB 3.04Å; D67-Q69 PolarHBondContact OD1-N 3.31Å
70	E	87.2	Confident	91.9	Very high	105 Å²	105	63.9 Å²	63.9	49%	0.491	33%	0.332	S	S	.	.	S	Bend	trans	-111.5	69.6	-179.6	-66.1	-162.3	103.5	0	0	110.7	D67 H72 M73	D67-E70 HydrophobicContact CB-CB 4.35Å; D67-E70 CarbonylContact O-C 3.59Å; D67-E70 PolarHBondContact OD1-N 3.39Å; E70-H72 PolarHBondContact O-N 2.87Å; E70-H72 IonicContact OE1-CE1 3.48Å; E70-H72 PolarHBondContact OE1-CE1 3.5Å; E70-M73 HydrophobicContact CB-CB 4.41Å; E70-M73 HydrophobicContact CB-CG 4.21Å; E70-M73 WeakPolarHBondContact O-CB 3.45Å; E70-M73 PolarHBondContact O-N 3Å
71	Q	86.1	Confident	92	Very high	33 Å²	33	63.3 Å²	63.3	15%	0.154	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-10.5	-173.4	-67.8	-166.7	-8.1	0	0	116.9	Y66 D67 M73 L206	Y66-Q71 HydrophobicContact CD2-CB 4.42Å; Y66-Q71 HydrophobicContact CD2-CG 3.94Å; Y66-Q71 HydrophobicContact CE2-CG 4.25Å; D67-Q71 WeakPolarHBondContact O-CA 3.44Å; D67-Q71 VanDerWaalsContact O-CG 3.25Å; D67-Q71 WeakPolarHBondContact O-CG 3.38Å; D67-Q71 PolarHBondContact O-N 3.09Å; Q71-M73 VanDerWaalsContact C-N 3.29Å; Q71-L206 HydrophobicContact CB-CB 4.28Å; Q71-L206 HydrophobicContact CB-CD2 4.34Å; Q71-L206 HydrophobicContact CG-CD2 3.69Å; Q71-L206 HydrophobicContact CG-CG 4.5Å
72	H	85.5	Confident	92.3	Very high	32 Å²	32	61 Å²	61	15%	0.148	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.2	169.6	73.8	-71.7	0	0	0	113.3	E70 S91 V92 K93	E70-H72 PolarHBondContact O-N 2.87Å; E70-H72 IonicContact OE1-CE1 3.48Å; E70-H72 PolarHBondContact OE1-CE1 3.5Å; H72-S91 PolarHBondContact CD2-OG 2.94Å; H72-S91 CarbonylContact O-C 3.5Å; H72-S91 WeakPolarHBondContact O-CA 3.45Å; H72-V92 PolarHBondContact O-N 2.76Å; H72-K93 HydrophobicContact CB-CG 4.29Å; H72-K93 VanDerWaalsContact CD2-CD 3.49Å; H72-K93 WeakPolarHBondContact CD2-CD 3.45Å; H72-K93 VanDerWaalsContact CD2-CE 3.4Å; H72-K93 WeakPolarHBondContact CD2-CE 3.33Å; H72-K93 PolarHBondContact CD2-NZ 2.79Å; H72-K93 PolarHBondContact NE2-NZ 3.41Å; H72-K93 VanDerWaalsContact NE2-NZ 3.11Å
73	M	92.3	Very high	92.4	Very high	37 Å²	37	62.5 Å²	62.5	18%	0.182	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.8	175.5	-71.9	-61.4	-64.9	0	0	110	Y66 D67 E70 Q71	Y66-M73 CarbonylContact C-O 3.49Å; Y66-M73 WeakPolarHBondContact CA-O 3.26Å; D67-M73 HydrophobicContact CB-CB 4.19Å; D67-M73 PolarHBondContact N-O 2.7Å; E70-M73 HydrophobicContact CB-CB 4.41Å; E70-M73 HydrophobicContact CB-CG 4.21Å; E70-M73 WeakPolarHBondContact O-CB 3.45Å; E70-M73 PolarHBondContact O-N 3Å; Q71-M73 VanDerWaalsContact C-N 3.29Å
74	V	93.9	Very high	92.5	Very high	2 Å²	2	59.5 Å²	59.5	1%	0.012	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123.3	177.9	-179.2	0	0	0	0	108.9	I60 L65 S89 F90 V92	I60-V74 HydrophobicContact CD1-CG1 4.25Å; I60-V74 HydrophobicContact CD1-CG2 4.43Å; I60-V74 HydrophobicContact CG1-CG1 4.25Å; I60-V74 HydrophobicContact CG2-CG1 4.03Å; I60-V74 HydrophobicContact CG2-CG2 4.06Å; L65-V74 HydrophobicContact CB-CG1 3.9Å; L65-V74 CarbonylContact O-C 3.46Å; L65-V74 WeakPolarHBondContact O-CA 3.07Å; V74-S89 CarbonylContact O-C 3.46Å; V74-S89 WeakPolarHBondContact O-CA 3.23Å; V74-S89 WeakPolarHBondContact O-CB 3.25Å; V74-F90 HydrophobicContact CB-CD1 4.14Å; V74-F90 HydrophobicContact CB-CE1 3.74Å; V74-F90 HydrophobicContact CB-CE2 4.42Å; V74-F90 HydrophobicContact CB-CZ 3.9Å; V74-F90 HydrophobicContact CG1-CD1 4.39Å; V74-F90 HydrophobicContact CG1-CE1 3.68Å; V74-F90 HydrophobicContact CG1-CZ 4.02Å; V74-F90 HydrophobicContact CG2-CE1 4.42Å; V74-F90 HydrophobicContact CG2-CE2 4.37Å; V74-F90 HydrophobicContact CG2-CZ 4.06Å; V74-F90 PolarHBondContact N-O 3.09Å; V74-F90 PolarHBondContact O-N 3.36Å; V74-V92 HydrophobicContact CG2-CG2 4.12Å
75	Y	96.2	Very high	92.5	Very high	110 Å²	110	54.4 Å²	54.4	43%	0.431	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	106.4	174.8	-62.7	-75.6	0	0	0	109.7	L65 D67	L65-Y75 PolarHBondContact O-N 3.02Å; D67-Y75 HydrophobicContact CB-CD2 4.34Å; D67-Y75 HydrophobicContact CB-CE2 3.81Å
76	C	95.3	Very high	92.4	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.007	32%	0.317	C	S	.	.			trans	-118.3	1.3	-170.2	54.3	0	0	0	0	114.5	L65 D79 L81 G82 C87 Q88	L65-C76 HydrophobicContact CD1-CB 4.46Å; C76-D79 WeakPolarHBondContact O-CA 3.49Å; C76-D79 WeakPolarHBondContact O-CB 3.11Å; C76-D79 PolarHBondContact O-N 3.29Å; C76-D79 VanDerWaalsContact O-N 3.09Å; C76-L81 HydrophobicContact CB-CB 4.33Å; C76-L81 HydrophobicContact CB-CD2 4.41Å; C76-L81 HydrophobicContact CB-CG 4.25Å; C76-G82 VanDerWaalsContact O-CA 3.23Å; C76-G82 WeakPolarHBondContact O-CA 3.49Å; C76-G82 PolarHBondContact O-N 3.4Å; C76-C87 PolarHBondContact SG-O 3.05Å; C76-C87 VanDerWaalsContact SG-O 3.34Å; C76-Q88 PolarHBondContact N-O 2.95Å
77	G	94.4	Very high	92.5	Very high	26 Å²	26	56.2 Å²	56.2	27%	0.268	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	146.2	-179.8	0	0	0	0	0	113.5	Q88	G77-Q88 VanDerWaalsContact C-NE2 3.34Å; G77-Q88 PolarHBondContact N-O 3.34Å; G77-Q88 PolarHBondContact O-NE2 2.94Å
78	G	93.4	Very high	92.6	Very high	83 Å²	83	60.4 Å²	60.4	86%	0.856	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	-2.5	-159.1	0	0	0	0	0	113.2
79	D	96.3	Very high	92.9	Very high	17 Å²	17	55.9 Å²	55.9	9%	0.091	33%	0.325	C	S	.	.	S	Bend	trans	-110.4	152.7	172.3	-168.4	-93.5	0	0	0	111.5	Y59 K63 L65 C76 L81 G82 D83	Y59-D79 WeakPolarHBondContact CE1-OD1 3.4Å; Y59-D79 VanDerWaalsContact CZ-OD1 3.31Å; Y59-D79 VanDerWaalsContact OH-CG 3.25Å; Y59-D79 PolarHBondContact OH-OD1 2.87Å; Y59-D79 PolarHBondContact OH-OD2 3.34Å; Y59-D79 VanDerWaalsContact OH-OD2 3.1Å; K63-D79 VanDerWaalsContact CD-OD2 3.27Å; K63-D79 WeakPolarHBondContact CD-OD2 3.32Å; K63-D79 WeakPolarHBondContact CE-OD2 3.37Å; K63-D79 IonicContact NZ-OD2 3.25Å; K63-D79 PolarHBondContact NZ-OD2 2.98Å; L65-D79 HydrophobicContact CD1-CB 4.43Å; L65-D79 HydrophobicContact CD2-CB 4.46Å; C76-D79 WeakPolarHBondContact O-CA 3.49Å; C76-D79 WeakPolarHBondContact O-CB 3.11Å; C76-D79 PolarHBondContact O-N 3.29Å; C76-D79 VanDerWaalsContact O-N 3.09Å; D79-L81 PolarHBondContact O-N 2.75Å; D79-L81 VanDerWaalsContact O-N 3.12Å; D79-L81 WeakPolarHBondContact OD1-CB 3.28Å; D79-L81 PolarHBondContact OD1-N 2.91Å; D79-G82 PolarHBondContact O-N 2.82Å; D79-D83 PolarHBondContact O-N 3.4Å; D79-D83 VanDerWaalsContact O-N 3.09Å
80	L	95.2	Very high	93.2	Very high	76 Å²	76	48 Å²	48	40%	0.398	29%	0.287	S	S	.	.	H	α-helix	trans	-53.5	-32.2	175	-66.3	174.9	0	0	0	112.6	I36 L84	I36-L80 HydrophobicContact CD1-CB 4.2Å; I36-L80 HydrophobicContact CG1-CB 4.09Å; L80-L84 WeakPolarHBondContact O-CB 3.4Å; L80-L84 PolarHBondContact O-N 3.33Å
81	L	95.8	Very high	93.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-66	-41.4	176.3	-179	58.3	0	0	0	111.9	I36 L56 Y59 I60 L65 C76 D79 L84 L85	I36-L81 HydrophobicContact CD1-CB 4.29Å; I36-L81 HydrophobicContact CD1-CD1 4.33Å; L56-L81 HydrophobicContact CD1-CD1 3.63Å; Y59-L81 HydrophobicContact CD1-CB 4.43Å; Y59-L81 HydrophobicContact CD1-CD2 4.14Å; Y59-L81 HydrophobicContact CE1-CB 3.83Å; Y59-L81 HydrophobicContact CE1-CD2 4.29Å; I60-L81 HydrophobicContact CD1-CD2 4.03Å; I60-L81 HydrophobicContact CG1-CD2 3.62Å; L65-L81 HydrophobicContact CD1-CD2 4.09Å; C76-L81 HydrophobicContact CB-CB 4.33Å; C76-L81 HydrophobicContact CB-CD2 4.41Å; C76-L81 HydrophobicContact CB-CG 4.25Å; D79-L81 PolarHBondContact O-N 2.75Å; D79-L81 VanDerWaalsContact O-N 3.12Å; D79-L81 WeakPolarHBondContact OD1-CB 3.28Å; D79-L81 PolarHBondContact OD1-N 2.91Å; L81-L84 PolarHBondContact O-N 3.16Å; L81-L85 HydrophobicContact CD1-CD1 3.82Å; L81-L85 HydrophobicContact CD1-CG 4.18Å; L81-L85 HydrophobicContact CG-CD1 3.75Å; L81-L85 WeakPolarHBondContact O-CB 3.38Å; L81-L85 WeakPolarHBondContact O-CD1 3.35Å; L81-L85 VanDerWaalsContact O-CG 3.26Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 3.01Å
82	G	95	Very high	93.4	Very high	5 Å²	5	43.9 Å²	43.9	5%	0.052	27%	0.273	C	S	.	.	H	α-helix	trans	-67.8	-39.6	175.8	0	0	0	0	0	112.5	C76 D79 L84 L85 G86 C87	C76-G82 VanDerWaalsContact O-CA 3.23Å; C76-G82 WeakPolarHBondContact O-CA 3.49Å; C76-G82 PolarHBondContact O-N 3.4Å; D79-G82 PolarHBondContact O-N 2.82Å; G82-L84 VanDerWaalsContact C-N 3.27Å; G82-L84 PolarHBondContact O-N 3.13Å; G82-L85 PolarHBondContact O-N 3.27Å; G82-G86 WeakPolarHBondContact O-CA 3.48Å; G82-G86 PolarHBondContact O-N 2.91Å; G82-C87 WeakPolarHBondContact CA-O 3.11Å; G82-C87 PolarHBondContact O-N 3.21Å
83	D	94.4	Very high	93.3	Very high	122 Å²	122	49 Å²	49	65%	0.652	29%	0.294	S	S	*	.	H	α-helix	trans	-61	-38.2	174.2	-66.1	-24.7	0	0	0	111.6	D79	D79-D83 PolarHBondContact O-N 3.4Å; D79-D83 VanDerWaalsContact O-N 3.09Å
84	L	95	Very high	93	Very high	30 Å²	30	51.3 Å²	51.3	16%	0.157	31%	0.308	C	S	.	.	H	α-helix	trans	-75.1	-38.6	179.7	-166	66.2	0	0	0	113	Q32 L33 I36 L80 L81 G82 G86 M101 N105	Q32-L84 HydrophobicContact CB-CD1 3.73Å; L33-L84 HydrophobicContact CB-CD2 3.82Å; L33-L84 HydrophobicContact CD1-CD2 3.83Å; L33-L84 HydrophobicContact CG-CD2 4.38Å; I36-L84 HydrophobicContact CD1-CB 4.35Å; I36-L84 HydrophobicContact CD1-CD2 3.76Å; L80-L84 WeakPolarHBondContact O-CB 3.4Å; L80-L84 PolarHBondContact O-N 3.33Å; L81-L84 PolarHBondContact O-N 3.16Å; G82-L84 VanDerWaalsContact C-N 3.27Å; G82-L84 PolarHBondContact O-N 3.13Å; L84-G86 VanDerWaalsContact C-N 3.34Å; L84-M101 HydrophobicContact CB-CG 4.46Å; L84-M101 HydrophobicContact CD2-CE 4.36Å; L84-M101 HydrophobicContact CD2-CG 4.14Å; L84-M101 HydrophobicContact CD2-SD 3.5Å; L84-M101 VanDerWaalsContact CD2-SD 3.5Å; L84-M101 HydrophobicContact CG-CG 3.77Å; L84-M101 HydrophobicContact CG-SD 3.82Å; L84-M101 WeakPolarHBondContact O-CG 3.49Å; L84-N105 WeakPolarHBondContact CD1-OD1 3.47Å
85	L	93	Very high	92.4	Very high	21 Å²	21	52.8 Å²	52.8	11%	0.11	32%	0.317	C	S	.	.	H	α-helix	trans	-74.3	-25.1	175.4	-72.3	163.1	0	0	0	112.2	L81 G82 C87 F90 L98 M101	L81-L85 HydrophobicContact CD1-CD1 3.82Å; L81-L85 HydrophobicContact CD1-CG 4.18Å; L81-L85 HydrophobicContact CG-CD1 3.75Å; L81-L85 WeakPolarHBondContact O-CB 3.38Å; L81-L85 WeakPolarHBondContact O-CD1 3.35Å; L81-L85 VanDerWaalsContact O-CG 3.26Å; L81-L85 WeakPolarHBondContact O-CG 3.36Å; L81-L85 PolarHBondContact O-N 3.01Å; G82-L85 PolarHBondContact O-N 3.27Å; L85-C87 HydrophobicContact CB-CB 4.4Å; L85-C87 PolarHBondContact O-N 3.43Å; L85-F90 HydrophobicContact CD1-CD1 3.64Å; L85-F90 HydrophobicContact CD1-CE1 3.46Å; L85-F90 VanDerWaalsContact CD1-CE1 3.46Å; L85-F90 HydrophobicContact CD1-CZ 4.37Å; L85-L98 HydrophobicContact CD2-CB 4.46Å; L85-M101 HydrophobicContact CD2-CB 3.66Å; L85-M101 HydrophobicContact CD2-CE 4.15Å; L85-M101 HydrophobicContact CD2-CG 3.96Å; L85-M101 HydrophobicContact CG-CB 4.49Å; L85-M101 HydrophobicContact CG-CG 4.33Å
86	G	93	Very high	92	Very high	68 Å²	68	50.4 Å²	50.4	70%	0.701	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	20.8	-171	0	0	0	0	0	113.3	G82 L84	G82-G86 WeakPolarHBondContact O-CA 3.48Å; G82-G86 PolarHBondContact O-N 2.91Å; L84-G86 VanDerWaalsContact C-N 3.34Å
87	C	93.3	Very high	91.7	Very high	49 Å²	49	52 Å²	52	33%	0.331	33%	0.328	S	S	.	.			trans	-133.1	145	-175.6	-64.2	0	0	0	0	110.7	C76 G82 L85	C76-C87 PolarHBondContact SG-O 3.05Å; C76-C87 VanDerWaalsContact SG-O 3.34Å; G82-C87 WeakPolarHBondContact CA-O 3.11Å; G82-C87 PolarHBondContact O-N 3.21Å; L85-C87 HydrophobicContact CB-CB 4.4Å; L85-C87 PolarHBondContact O-N 3.43Å
88	Q	94.9	Very high	91.5	Very high	129 Å²	129	51.5 Å²	51.5	60%	0.603	32%	0.318	S	S	*	.	S	Bend	trans	-76.9	-28.7	176.1	-173.6	64.9	41.7	0	0	112	C76 G77	C76-Q88 PolarHBondContact N-O 2.95Å; G77-Q88 VanDerWaalsContact C-NE2 3.34Å; G77-Q88 PolarHBondContact N-O 3.34Å; G77-Q88 PolarHBondContact O-NE2 2.94Å
89	S	94.7	Very high	91.3	Very high	46 Å²	46	49.1 Å²	49.1	32%	0.322	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	160.2	176.5	55.8	0	0	0	0	111.1	V74	V74-S89 CarbonylContact O-C 3.46Å; V74-S89 WeakPolarHBondContact O-CA 3.23Å; V74-S89 WeakPolarHBondContact O-CB 3.25Å
90	F	93	Very high	91	Very high	14 Å²	14	52.2 Å²	52.2	6%	0.061	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	163.9	171.9	69.7	-82.8	0	0	0	111	I60 V74 L85 P97 L98	I60-F90 HydrophobicContact CD1-CZ 4.03Å; V74-F90 HydrophobicContact CB-CD1 4.14Å; V74-F90 HydrophobicContact CB-CE1 3.74Å; V74-F90 HydrophobicContact CB-CE2 4.42Å; V74-F90 HydrophobicContact CB-CZ 3.9Å; V74-F90 HydrophobicContact CG1-CD1 4.39Å; V74-F90 HydrophobicContact CG1-CE1 3.68Å; V74-F90 HydrophobicContact CG1-CZ 4.02Å; V74-F90 HydrophobicContact CG2-CE1 4.42Å; V74-F90 HydrophobicContact CG2-CE2 4.37Å; V74-F90 HydrophobicContact CG2-CZ 4.06Å; V74-F90 PolarHBondContact N-O 3.09Å; V74-F90 PolarHBondContact O-N 3.36Å; L85-F90 HydrophobicContact CD1-CD1 3.64Å; L85-F90 HydrophobicContact CD1-CE1 3.46Å; L85-F90 VanDerWaalsContact CD1-CE1 3.46Å; L85-F90 HydrophobicContact CD1-CZ 4.37Å; F90-P97 HydrophobicContact CB-CG 4.42Å; F90-L98 HydrophobicContact CE2-CD1 4.07Å; F90-L98 HydrophobicContact CZ-CD1 4.23Å
91	S	90.5	Very high	91	Very high	26 Å²	26	48.8 Å²	48.8	18%	0.182	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.1	177.3	178.2	0	0	0	0	109.9	H72 K93 D94	H72-S91 PolarHBondContact CD2-OG 2.94Å; H72-S91 CarbonylContact O-C 3.5Å; H72-S91 WeakPolarHBondContact O-CA 3.45Å; S91-K93 PolarHBondContact O-N 3.36Å; S91-K93 PolarHBondContact OG-N 2.96Å; S91-D94 CarbonylContact O-C 3.17Å; S91-D94 PolarHBondContact O-N 3.11Å
92	V	86.7	Confident	90.8	Very high	26 Å²	26	48.8 Å²	48.8	16%	0.158	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.6	173.1	177.7	0	0	0	0	111.4	H72 V74 D94 W201 F202	H72-V92 PolarHBondContact O-N 2.76Å; V74-V92 HydrophobicContact CG2-CG2 4.12Å; V92-D94 PolarHBondContact O-N 3.3Å; V92-W201 WeakPolarHBondContact CG1-O 3.42Å; V92-F202 WeakPolarHBondContact CG1-O 3.42Å
93	K	84	Confident	90.5	Very high	139 Å²	139	54.5 Å²	54.5	60%	0.604	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-25.7	174.7	-63.9	176.8	-178.3	157	0	112.5	H72 S91 P95	H72-K93 HydrophobicContact CB-CG 4.29Å; H72-K93 VanDerWaalsContact CD2-CD 3.49Å; H72-K93 WeakPolarHBondContact CD2-CD 3.45Å; H72-K93 VanDerWaalsContact CD2-CE 3.4Å; H72-K93 WeakPolarHBondContact CD2-CE 3.33Å; H72-K93 PolarHBondContact CD2-NZ 2.79Å; H72-K93 PolarHBondContact NE2-NZ 3.41Å; H72-K93 VanDerWaalsContact NE2-NZ 3.11Å; S91-K93 PolarHBondContact O-N 3.36Å; S91-K93 PolarHBondContact OG-N 2.96Å; K93-P95 WeakPolarHBondContact O-CD 3.44Å
94	D	84.3	Confident	90.4	Very high	86 Å²	86	55.3 Å²	55.3	46%	0.46	30%	0.3	S	S	.	.			trans	-120.6	81.5	174.5	-179.6	18.4	0	0	0	109.4	S91 V92 S96 P97	S91-D94 CarbonylContact O-C 3.17Å; S91-D94 PolarHBondContact O-N 3.11Å; V92-D94 PolarHBondContact O-N 3.3Å; D94-S96 PolarHBondContact O-N 2.97Å; D94-S96 VanDerWaalsContact O-N 3.1Å; D94-S96 VanDerWaalsContact OD1-CB 3.32Å; D94-S96 WeakPolarHBondContact OD1-CB 3.47Å; D94-S96 PolarHBondContact OD1-N 2.8Å; D94-S96 PolarHBondContact OD1-OG 2.83Å; D94-P97 WeakPolarHBondContact O-CD 3.2Å
95	P	81.1	Confident	90.3	Very high	33 Å²	33	54.8 Å²	54.8	21%	0.214	30%	0.298	C	S	.	.			trans	-74.1	4.8	-176.1	32.2	-37.6	0	0	0	113.5	K93 P97 L98 Y99	K93-P95 WeakPolarHBondContact O-CD 3.44Å; P95-P97 VanDerWaalsContact C-CD 3.48Å; P95-L98 WeakPolarHBondContact O-CA 3.34Å; P95-L98 WeakPolarHBondContact O-CB 3.49Å; P95-L98 PolarHBondContact O-N 2.9Å; P95-Y99 HydrophobicContact CB-CD2 4.04Å; P95-Y99 HydrophobicContact CB-CE2 3.66Å; P95-Y99 HydrophobicContact CG-CD2 4.08Å; P95-Y99 HydrophobicContact CG-CE2 3.47Å; P95-Y99 VanDerWaalsContact CG-CE2 3.47Å; P95-Y99 WeakPolarHBondContact O-CD2 3.29Å; P95-Y99 PolarHBondContact O-N 2.94Å
96	S	87.9	Confident	90.3	Very high	60 Å²	60	54.1 Å²	54.1	42%	0.42	29%	0.294	S	S	.	.	H	α-helix	trans	-51.3	-47.4	-178.6	-50.8	0	0	0	0	113.4	D94 L98 Y99 D100	D94-S96 PolarHBondContact O-N 2.97Å; D94-S96 VanDerWaalsContact O-N 3.1Å; D94-S96 VanDerWaalsContact OD1-CB 3.32Å; D94-S96 WeakPolarHBondContact OD1-CB 3.47Å; D94-S96 PolarHBondContact OD1-N 2.8Å; D94-S96 PolarHBondContact OD1-OG 2.83Å; S96-L98 PolarHBondContact O-N 2.77Å; S96-Y99 PolarHBondContact O-N 3.09Å; S96-D100 PolarHBondContact O-N 3Å
97	P	89.9	Confident	90.2	Very high	36 Å²	36	54.2 Å²	54.2	23%	0.234	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-33.9	178.1	-22	34.8	0	0	0	113	F90 D94 P95 M101	F90-P97 HydrophobicContact CB-CG 4.42Å; D94-P97 WeakPolarHBondContact O-CD 3.2Å; P95-P97 VanDerWaalsContact C-CD 3.48Å; P97-M101 WeakPolarHBondContact O-CB 3.5Å; P97-M101 PolarHBondContact O-N 3.48Å; P97-M101 VanDerWaalsContact O-N 3.09Å
98	L	90.4	Very high	89.8	Confident	15 Å²	15	54.4 Å²	54.4	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-70.9	-45.7	178.9	-173.4	153.2	0	0	0	110.4	M53 L56 L85 F90 P95 S96 D100 M101 L102	M53-L98 HydrophobicContact CE-CD2 3.83Å; M53-L98 HydrophobicContact SD-CD2 3.57Å; M53-L98 VanDerWaalsContact SD-CD2 3.57Å; L56-L98 HydrophobicContact CD2-CD1 3.65Å; L56-L98 HydrophobicContact CD2-CD2 4.09Å; L56-L98 HydrophobicContact CD2-CG 3.83Å; L85-L98 HydrophobicContact CD2-CB 4.46Å; F90-L98 HydrophobicContact CE2-CD1 4.07Å; F90-L98 HydrophobicContact CZ-CD1 4.23Å; P95-L98 WeakPolarHBondContact O-CA 3.34Å; P95-L98 WeakPolarHBondContact O-CB 3.49Å; P95-L98 PolarHBondContact O-N 2.9Å; S96-L98 PolarHBondContact O-N 2.77Å; L98-D100 PolarHBondContact O-N 2.93Å; L98-M101 WeakPolarHBondContact O-CB 3.39Å; L98-M101 PolarHBondContact O-N 3.26Å; L98-L102 HydrophobicContact CD2-CD1 3.56Å; L98-L102 HydrophobicContact CD2-CG 4.12Å; L98-L102 WeakPolarHBondContact O-CG 3.34Å; L98-L102 PolarHBondContact O-N 3.5Å
99	Y	88.6	Confident	88.9	Confident	32 Å²	32	50 Å²	50	13%	0.125	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-40.7	176.3	-67.6	-46.2	0	0	0	112.7	M53 P95 S96 M101 L102 R103 F190	M53-Y99 HydrophobicContact CE-CD1 4.39Å; M53-Y99 HydrophobicContact CE-CE1 3.55Å; P95-Y99 HydrophobicContact CB-CD2 4.04Å; P95-Y99 HydrophobicContact CB-CE2 3.66Å; P95-Y99 HydrophobicContact CG-CD2 4.08Å; P95-Y99 HydrophobicContact CG-CE2 3.47Å; P95-Y99 VanDerWaalsContact CG-CE2 3.47Å; P95-Y99 WeakPolarHBondContact O-CD2 3.29Å; P95-Y99 PolarHBondContact O-N 2.94Å; S96-Y99 PolarHBondContact O-N 3.09Å; Y99-M101 VanDerWaalsContact C-N 3.29Å; Y99-M101 PolarHBondContact O-N 3.25Å; Y99-L102 HydrophobicContact CD1-CD1 4.39Å; Y99-L102 PolarHBondContact O-N 3.26Å; Y99-R103 VanDerWaalsContact O-CG 3.28Å; Y99-R103 WeakPolarHBondContact O-CG 3.26Å; Y99-R103 PolarHBondContact O-N 2.97Å; Y99-F190 AromaticContact CD1-CD1 3.43Å; Y99-F190 HydrophobicContact CD1-CD1 3.43Å; Y99-F190 VanDerWaalsContact CD1-CD1 3.43Å; Y99-F190 AromaticContact CD1-CE1 3.51Å; Y99-F190 HydrophobicContact CD1-CE1 3.51Å; Y99-F190 HydrophobicContact CD1-CG 4.18Å; Y99-F190 HydrophobicContact CD1-CZ 4.3Å; Y99-F190 AromaticContact CE1-CD1 3.51Å; Y99-F190 HydrophobicContact CE1-CD1 3.51Å; Y99-F190 AromaticContact CE1-CE1 3.96Å; Y99-F190 HydrophobicContact CE1-CE1 3.96Å; Y99-F190 HydrophobicContact CE1-CG 4.33Å; Y99-F190 HydrophobicContact CG-CD1 4.21Å; Y99-F190 HydrophobicContact CG-CE1 4.35Å
100	D	91.1	Very high	87.2	Confident	82 Å²	82	52 Å²	52	44%	0.439	28%	0.283	S	S	.	.	H	α-helix	trans	-61.3	-40.3	175.2	-76.7	-16.3	0	0	0	111.8	S96 L98 K104	S96-D100 PolarHBondContact O-N 3Å; L98-D100 PolarHBondContact O-N 2.93Å; D100-K104 WeakPolarHBondContact O-CD 3.43Å; D100-K104 VanDerWaalsContact O-CG 3.28Å; D100-K104 WeakPolarHBondContact O-CG 3.48Å; D100-K104 PolarHBondContact O-N 3.37Å
101	M	94	Very high	85	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.025	30%	0.301	C	S	.	.	H	α-helix	trans	-64.5	-44.4	174.3	178.7	-77.3	-70.6	0	0	111.5	L33 L56 L84 L85 P97 L98 Y99 K104 N105	L33-M101 HydrophobicContact CD1-CE 4.31Å; L33-M101 HydrophobicContact CD1-SD 4.25Å; L33-M101 HydrophobicContact CD2-SD 4.44Å; L56-M101 HydrophobicContact CD2-CE 4.02Å; L84-M101 HydrophobicContact CB-CG 4.46Å; L84-M101 HydrophobicContact CD2-CE 4.36Å; L84-M101 HydrophobicContact CD2-CG 4.14Å; L84-M101 HydrophobicContact CD2-SD 3.5Å; L84-M101 VanDerWaalsContact CD2-SD 3.5Å; L84-M101 HydrophobicContact CG-CG 3.77Å; L84-M101 HydrophobicContact CG-SD 3.82Å; L84-M101 WeakPolarHBondContact O-CG 3.49Å; L85-M101 HydrophobicContact CD2-CB 3.66Å; L85-M101 HydrophobicContact CD2-CE 4.15Å; L85-M101 HydrophobicContact CD2-CG 3.96Å; L85-M101 HydrophobicContact CG-CB 4.49Å; L85-M101 HydrophobicContact CG-CG 4.33Å; P97-M101 WeakPolarHBondContact O-CB 3.5Å; P97-M101 PolarHBondContact O-N 3.48Å; P97-M101 VanDerWaalsContact O-N 3.09Å; L98-M101 WeakPolarHBondContact O-CB 3.39Å; L98-M101 PolarHBondContact O-N 3.26Å; Y99-M101 VanDerWaalsContact C-N 3.29Å; Y99-M101 PolarHBondContact O-N 3.25Å; M101-K104 PolarHBondContact O-N 3.02Å; M101-N105 VanDerWaalsContact O-CB 3.29Å; M101-N105 WeakPolarHBondContact O-CB 3.18Å; M101-N105 PolarHBondContact O-N 2.82Å; M101-N105 PolarHBondContact O-ND2 2.88Å; M101-N105 HydrophobicContact SD-CB 4.16Å
102	L	92.1	Very high	82.9	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63.1	-44.5	179	-70.9	178.3	0	0	0	112	L33 M49 V52 M53 L98 Y99 K104 N105 L106	L33-L102 HydrophobicContact CD2-CD2 3.87Å; M49-L102 HydrophobicContact SD-CD1 4.03Å; V52-L102 HydrophobicContact CG1-CD2 3.63Å; M53-L102 HydrophobicContact CE-CD1 4.43Å; M53-L102 HydrophobicContact SD-CD1 3.64Å; L98-L102 HydrophobicContact CD2-CD1 3.56Å; L98-L102 HydrophobicContact CD2-CG 4.12Å; L98-L102 WeakPolarHBondContact O-CG 3.34Å; L98-L102 PolarHBondContact O-N 3.5Å; Y99-L102 HydrophobicContact CD1-CD1 4.39Å; Y99-L102 PolarHBondContact O-N 3.26Å; L102-K104 PolarHBondContact O-N 3.24Å; L102-N105 PolarHBondContact O-N 2.76Å; L102-L106 HydrophobicContact CB-CD1 3.99Å; L102-L106 HydrophobicContact CD2-CD1 4.18Å; L102-L106 WeakPolarHBondContact O-CB 3.23Å; L102-L106 VanDerWaalsContact O-CG 3.24Å; L102-L106 WeakPolarHBondContact O-CG 3.28Å; L102-L106 PolarHBondContact O-N 3.29Å
103	R	89.7	Confident	80.9	Confident	126 Å²	126	64.1 Å²	64.1	48%	0.475	35%	0.349	S	S	.	.	H	α-helix	trans	-57.4	-37.2	176.2	-69.8	170.3	-170.7	-145.5	-0.2	112	Y99 F190	Y99-R103 VanDerWaalsContact O-CG 3.28Å; Y99-R103 WeakPolarHBondContact O-CG 3.26Å; Y99-R103 PolarHBondContact O-N 2.97Å; R103-F190 HydrophobicContact CG-CE2 3.9Å; R103-F190 HydrophobicContact CG-CZ 3.97Å
104	K	91.4	Very high	78.9	Confident	139 Å²	139	63.1 Å²	63.1	60%	0.604	36%	0.355	S	S	*	.	H	α-helix	trans	-78.5	-23.7	177.7	-67.7	169.3	-173.8	171.2	0	113.4	K30 D100 M101 L102	K30-K104 VanDerWaalsContact CE-O 3.23Å; K30-K104 WeakPolarHBondContact CE-O 3.31Å; K30-K104 PolarHBondContact NZ-O 2.6Å; D100-K104 WeakPolarHBondContact O-CD 3.43Å; D100-K104 VanDerWaalsContact O-CG 3.28Å; D100-K104 WeakPolarHBondContact O-CG 3.48Å; D100-K104 PolarHBondContact O-N 3.37Å; M101-K104 PolarHBondContact O-N 3.02Å; L102-K104 PolarHBondContact O-N 3.24Å
105	N	93	Very high	77	Confident	19 Å²	19	61.6 Å²	61.6	10%	0.102	35%	0.347	C	S	.	.	H	α-helix	trans	-111.9	0.1	-170.5	-73.8	-72	0	0	0	115.2	K30 L33 L84 M101 L102	K30-N105 WeakPolarHBondContact CG-O 3.22Å; K30-N105 PolarHBondContact N-O 2.72Å; L33-N105 HydrophobicContact CB-CB 4.13Å; L33-N105 HydrophobicContact CD2-CB 3.87Å; L84-N105 WeakPolarHBondContact CD1-OD1 3.47Å; M101-N105 VanDerWaalsContact O-CB 3.29Å; M101-N105 WeakPolarHBondContact O-CB 3.18Å; M101-N105 PolarHBondContact O-N 2.82Å; M101-N105 PolarHBondContact O-ND2 2.88Å; M101-N105 HydrophobicContact SD-CB 4.16Å; L102-N105 PolarHBondContact O-N 2.76Å
106	L	92.8	Very high	75.3	Confident	7 Å²	7	64.5 Å²	64.5	4%	0.037	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	149.9	175.7	-63.2	174.5	0	0	0	110.5	V27 P29 L33 M49 V52 L102 L186	V27-L106 HydrophobicContact CB-CB 4.35Å; V27-L106 HydrophobicContact CB-CD1 4.44Å; V27-L106 HydrophobicContact CB-CD2 4.23Å; V27-L106 HydrophobicContact CG2-CD1 4.2Å; V27-L106 HydrophobicContact CG2-CD2 3.97Å; P29-L106 HydrophobicContact CB-CD2 3.97Å; P29-L106 HydrophobicContact CG-CD2 3.79Å; L33-L106 HydrophobicContact CD2-CD2 3.77Å; L33-L106 HydrophobicContact CD2-CG 4.28Å; M49-L106 HydrophobicContact CE-CD1 3.3Å; M49-L106 HydrophobicContact SD-CD1 3.5Å; M49-L106 WeakPolarHBondContact SD-CD1 3.46Å; V52-L106 HydrophobicContact CG2-CD2 4.25Å; L102-L106 HydrophobicContact CB-CD1 3.99Å; L102-L106 HydrophobicContact CD2-CD1 4.18Å; L102-L106 WeakPolarHBondContact O-CB 3.23Å; L102-L106 VanDerWaalsContact O-CG 3.24Å; L102-L106 WeakPolarHBondContact O-CG 3.28Å; L102-L106 PolarHBondContact O-N 3.29Å; L106-L186 HydrophobicContact CB-CD1 3.87Å; L106-L186 WeakPolarHBondContact O-CD1 3.4Å
107	V	90.5	Very high	73.5	Confident	70 Å²	70	65 Å²	65	42%	0.424	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	121.5	170.2	-178.5	0	0	0	0	107	R28 S109	R28-V107 PolarHBondContact N-O 2.78Å; R28-V107 PolarHBondContact O-N 2.83Å; V107-S109 PolarHBondContact O-N 2.97Å
108	T	86.3	Confident	71.6	Confident	52 Å²	52	70 Å²	70	32%	0.319	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	125	177	-70.5	0	0	0	0	109.3	L186	T108-L186 WeakPolarHBondContact OG1-CD2 3.5Å
109	S	75.1	Confident	69.5	Low	36 Å²	36	74.6 Å²	74.6	25%	0.252	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-82.8	117	168.6	-60.2	0	0	0	0	106.4	Q26 V107 S111	Q26-S109 PolarHBondContact O-N 2.92Å; V107-S109 PolarHBondContact O-N 2.97Å; S109-S111 PolarHBondContact O-N 3.24Å; S109-S111 VanDerWaalsContact O-N 3.08Å
110	A	58.2	Low	67.4	Low	88 Å²	88	78.4 Å²	78.4	73%	0.727	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-54.5	121.6	172.7	0	0	0	0	0	108	I112	A110-I112 PolarHBondContact O-N 3.05Å; A110-I112 VanDerWaalsContact O-N 3.1Å
111	S	47.9	Very low	65.2	Low	64 Å²	64	78.4 Å²	78.4	45%	0.448	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-52.8	121.9	174	-171.7	0	0	0	0	107.8	S109 N113	S109-S111 PolarHBondContact O-N 3.24Å; S109-S111 VanDerWaalsContact O-N 3.08Å; S111-N113 PolarHBondContact O-N 3.25Å; S111-N113 PolarHBondContact OG-OD1 3.26Å
112	I	46.4	Very low	63	Low	152 Å²	152	85.4 Å²	85.4	78%	0.779	50%	0.5	S	S	*	.			trans	-73.8	68.9	166.6	-51.4	172.5	0	0	0	106	A110 T114	A110-I112 PolarHBondContact O-N 3.05Å; A110-I112 VanDerWaalsContact O-N 3.1Å; I112-T114 PolarHBondContact O-N 3.03Å
113	N	43.8	Very low	60.7	Low	105 Å²	105	88.4 Å²	88.4	56%	0.561	53%	0.525	S	S	*	.			trans	-68.9	99.7	153.6	-68.5	7.4	0	0	0	102.9	S111 D115	S111-N113 PolarHBondContact O-N 3.25Å; S111-N113 PolarHBondContact OG-OD1 3.26Å; N113-D115 VanDerWaalsContact C-N 3.28Å; N113-D115 PolarHBondContact O-N 2.93Å
114	T	43	Very low	58.6	Low	119 Å²	119	90 Å²	90	73%	0.73	54%	0.538	S	S	*	.			trans	-50.2	104.3	174.7	-61.6	0	0	0	0	106.8	I112 A116	I112-T114 PolarHBondContact O-N 3.03Å; T114-A116 VanDerWaalsContact C-N 3.33Å; T114-A116 PolarHBondContact O-N 2.94Å
115	D	44.1	Very low	56.2	Low	53 Å²	53	90.8 Å²	90.8	28%	0.283	55%	0.549	S	S	.	.			trans	-55.9	97.1	165.3	172.9	52	0	0	0	108.6	N113 A117 Q118 T119	N113-D115 VanDerWaalsContact C-N 3.28Å; N113-D115 PolarHBondContact O-N 2.93Å; D115-A117 PolarHBondContact OD1-N 2.8Å; D115-A117 VanDerWaalsContact OD1-N 3.1Å; D115-Q118 VanDerWaalsContact CG-CB 3.44Å; D115-Q118 VanDerWaalsContact CG-NE2 3.33Å; D115-Q118 WeakPolarHBondContact OD1-CB 3.28Å; D115-Q118 WeakPolarHBondContact OD1-CG 3.32Å; D115-Q118 PolarHBondContact OD1-N 2.78Å; D115-Q118 PolarHBondContact OD1-NE2 3.24Å; D115-Q118 WeakPolarHBondContact OD2-CA 3.24Å; D115-Q118 WeakPolarHBondContact OD2-CB 3.33Å; D115-Q118 PolarHBondContact OD2-N 3.22Å; D115-T119 PolarHBondContact OD2-N 3.42Å
116	A	46.2	Very low	54.2	Low	94 Å²	94	96.6 Å²	96.6	78%	0.777	58%	0.575	S	S	*	*	S	Bend	trans	-86.5	6.7	163	0	0	0	0	0	111.5	T114	T114-A116 VanDerWaalsContact C-N 3.33Å; T114-A116 PolarHBondContact O-N 2.94Å
117	A	48.9	Very low	51.8	Low	72 Å²	72	102 Å²	102	60%	0.595	61%	0.608	S	S	*	*	S	Bend	trans	-117.8	-25.8	-171.9	0	0	0	0	0	115.3	D115	D115-A117 PolarHBondContact OD1-N 2.8Å; D115-A117 VanDerWaalsContact OD1-N 3.1Å
118	Q	50.8	Low	49.1	Very low	139 Å²	139	106.5 Å²	106.5	65%	0.65	63%	0.627	S	S	*	*	S	Bend	trans	-95.7	-6.3	-177.1	-47.7	153.9	57.3	0	0	113	D115 L120	D115-Q118 VanDerWaalsContact CG-CB 3.44Å; D115-Q118 VanDerWaalsContact CG-NE2 3.33Å; D115-Q118 WeakPolarHBondContact OD1-CB 3.28Å; D115-Q118 WeakPolarHBondContact OD1-CG 3.32Å; D115-Q118 PolarHBondContact OD1-N 2.78Å; D115-Q118 PolarHBondContact OD1-NE2 3.24Å; D115-Q118 WeakPolarHBondContact OD2-CA 3.24Å; D115-Q118 WeakPolarHBondContact OD2-CB 3.33Å; D115-Q118 PolarHBondContact OD2-N 3.22Å; Q118-L120 VanDerWaalsContact C-N 3.31Å
119	T	45.8	Very low	46.5	Very low	113 Å²	113	111.3 Å²	111.3	69%	0.693	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-16.5	165.4	-56.8	0	0	0	0	112.9	D115	D115-T119 PolarHBondContact OD2-N 3.42Å
120	L	45.1	Very low	44.6	Very low	112 Å²	112	118 Å²	118	59%	0.586	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-16.9	175.1	-77	174.7	0	0	0	114.5	Q118	Q118-L120 VanDerWaalsContact C-N 3.31Å
121	A	44.4	Very low	43.5	Very low	81 Å²	81	119.6 Å²	119.6	67%	0.669	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-16	-177.8	0	0	0	0	0	114.3
122	L	46.9	Very low	42.8	Very low	152 Å²	152	122.6 Å²	122.6	80%	0.796	70%	0.7	S	S	*	*	S	Bend	trans	-98.7	-6.4	175.2	-80.3	165	0	0	0	114	H126	L122-H126 PolarHBondContact O-CE1 3.45Å
123	A	44.8	Very low	42.4	Very low	63 Å²	63	124.2 Å²	124.2	52%	0.521	70%	0.704	S	S	.	*	S	Bend	trans	-107.6	2.4	-177.1	0	0	0	0	0	114.3
124	Q	46.3	Very low	42	Very low	161 Å²	161	126.1 Å²	126.1	75%	0.752	71%	0.714	S	S	*	*	S	Bend	trans	-111.4	19	-176.4	-77.6	-167.9	-8.9	0	0	115.2
125	D	41	Very low	41.5	Very low	154 Å²	154	130 Å²	130	82%	0.824	72%	0.715	S	S	*	*	S	Bend	trans	-125.7	27	178.9	-142.2	13.9	0	0	0	114.8
126	H	50.3	Low	41	Very low	141 Å²	141	132.2 Å²	132.2	65%	0.653	73%	0.727	S	S	*	*			trans	-146.4	75	169.4	35.3	-85.4	0	0	0	110.4	L122	L122-H126 PolarHBondContact O-CE1 3.45Å
127	T	41.3	Very low	40.5	Very low	120 Å²	120	137.8 Å²	137.8	74%	0.736	73%	0.733	S	S	*	*			trans	-143.1	104.9	158.1	-69.3	0	0	0	0	108.7
128	M	34.2	Very low	39.5	Very low	166 Å²	166	142.8 Å²	142.8	82%	0.818	74%	0.744	S	S	*	*			trans	132.8	83.2	148.9	-64.5	-43	179.3	0	0	112.6
129	D	32.8	Very low	38.4	Very low	153 Å²	153	139.9 Å²	139.9	82%	0.818	75%	0.752	S	S	*	*			trans	-149.7	145.1	133.3	-160.3	32.1	0	0	0	110.6
130	F	33.8	Very low	37.8	Very low	175 Å²	175	139.4 Å²	139.4	77%	0.768	76%	0.759	S	S	*	*			trans	-76.9	154.7	-154.1	-66.7	-101.6	0	0	0	115.5
131	P	36.3	Very low	37.2	Very low	123 Å²	123	140.3 Å²	140.3	80%	0.799	77%	0.769	S	S	*	*			trans	-87.4	112	170.9	32.9	-27.2	0	0	0	110.8	Q133	P131-Q133 PolarHBondContact O-N 3.1Å
132	S	32.3	Very low	36.6	Very low	126 Å²	126	145.3 Å²	145.3	88%	0.881	78%	0.779	S	S	*	*			trans	-89.2	98	165.6	53	0	0	0	0	109.9
133	Q	38	Very low	35.9	Very low	187 Å²	187	148.7 Å²	148.7	87%	0.874	78%	0.783	S	S	*	*			trans	-96	104	170.2	-173.1	179.7	-5.9	0	0	108.5	P131	P131-Q133 PolarHBondContact O-N 3.1Å
134	D	35.4	Very low	35.1	Very low	145 Å²	145	150.6 Å²	150.6	78%	0.775	79%	0.792	S	S	*	*			trans	-131	95.2	163.1	-156.5	19.7	0	0	0	111.3
135	R	32.8	Very low	34.5	Very low	200 Å²	200	150.5 Å²	150.5	76%	0.755	80%	0.796	S	S	*	*			trans	49.6	121.4	134.2	-61.3	-158.4	105.8	-149.9	-3	122.4
136	L	32.9	Very low	34.5	Very low	100 Å²	100	148.8 Å²	148.8	52%	0.524	79%	0.794	S	S	.	*				66.7	117.1	127.8	-83.3	147.5	0	0	0	119.9
137	K	35.8	Very low	33.7	Very low	210 Å²	210	152.2 Å²	152.2	91%	0.913	80%	0.801	S	S	*	*				-166	144.4	104.2	-110.5	174.4	177.3	-179.5	0	114
138	H	29	Very low	33.3	Very low	178 Å²	178	154.1 Å²	154.1	82%	0.824	80%	0.799	S	S	*	*			trans	-80.8	161.5	-172.7	-78.4	-96.1	0	0	0	115.6
139	G	27.9	Very low	33.3	Very low	78 Å²	78	157 Å²	157	80%	0.804	80%	0.801	S	S	*	*			trans	119.6	138.8	140.3	0	0	0	0	0	113.5
140	A	31.6	Very low	33.2	Very low	102 Å²	102	155.2 Å²	155.2	84%	0.843	80%	0.796	S	S	*	*			cis	-164.1	158.7	-6.9	0	0	0	0	0	107.3
141	T	34.4	Very low	33.3	Very low	132 Å²	132	154.5 Å²	154.5	81%	0.81	80%	0.795	S	S	*	*			trans	-53.6	146.7	177	-46.6	0	0	0	0	115.3
142	E	30.1	Very low	33.3	Very low	185 Å²	185	156.3 Å²	156.3	86%	0.864	79%	0.793	S	S	*	*			trans	168.6	106.6	137.8	-93.6	164.9	-170.8	0	0	110
143	Y	32.5	Very low	33.2	Very low	224 Å²	224	157.7 Å²	157.7	88%	0.878	79%	0.785	S	S	*	*				71.3	136.5	90.4	-138.8	-90.6	0	0	0	116.7
144	S	28.6	Very low	32.9	Very low	103 Å²	103	154.7 Å²	154.7	72%	0.72	78%	0.775	S	S	*	*			trans	97.9	108.5	159.6	72.7	0	0	0	0	121.1
145	N	34.2	Very low	32.8	Very low	158 Å²	158	152.2 Å²	152.2	85%	0.845	77%	0.765	S	S	*	*			trans	-72.4	158.2	143.7	-91	-36.7	0	0	0	109
146	P	40.5	Very low	32.8	Very low	119 Å²	119	150.7 Å²	150.7	77%	0.773	77%	0.767	S	S	*	*				-161.9	160.3	85.3	43	-21.6	0	0	0	119.7
147	R	32.8	Very low	32.7	Very low	212 Å²	212	152.3 Å²	152.3	80%	0.8	78%	0.781	S	S	*	*			trans	73.4	120.5	134.6	-106.8	-174.2	166.4	169.9	-3.8	124.8
148	K	33.8	Very low	32.8	Very low	160 Å²	160	150.2 Å²	150.2	70%	0.696	78%	0.778	S	S	*	*				98.3	142.1	109.9	-124.5	-173.7	-178.2	-165.4	0	123.1
149	R	33	Very low	33.2	Very low	227 Å²	227	147.3 Å²	147.3	86%	0.857	78%	0.776	S	S	*	*			trans	103.3	119.7	160.3	-62.6	-164.9	-147.7	-171.8	6.6	113.7
150	T	31.6	Very low	33.7	Very low	116 Å²	116	150.2 Å²	150.2	71%	0.712	78%	0.778	S	S	*	*			cis	59.6	116.5	30.7	-12.7	0	0	0	0	112.2
151	E	35.3	Very low	34	Very low	159 Å²	159	150.4 Å²	150.4	74%	0.743	77%	0.773	S	S	*	*				-169	142.5	62.9	-83.5	162.6	174.2	0	0	110.2
152	E	36.5	Very low	34.3	Very low	161 Å²	161	155.5 Å²	155.5	75%	0.752	78%	0.777	S	S	*	*				86.8	117	115.5	-75.3	-173.1	167.6	0	0	115.5
153	E	31.5	Very low	34.5	Very low	155 Å²	155	155.7 Å²	155.7	72%	0.724	78%	0.778	S	S	*	*				103.1	113	75.9	-169	177.9	116	0	0	109.3
154	D	30.3	Very low	34.6	Very low	125 Å²	125	154.3 Å²	154.3	67%	0.668	78%	0.776	S	S	*	*				150.5	141.7	108.8	-134.9	-4.9	0	0	0	116.4
155	T	34.3	Very low	34.5	Very low	92 Å²	92	154.8 Å²	154.8	56%	0.564	78%	0.778	S	S	*	*			trans	64.7	119.5	149.3	60.8	0	0	0	0	125.7
156	H	31.9	Very low	34.5	Very low	169 Å²	169	157 Å²	157	78%	0.782	78%	0.775	S	S	*	*				74.8	134.2	127.6	-63	-55.6	0	0	0	124.4
157	T	30.5	Very low	34.2	Very low	134 Å²	134	157.8 Å²	157.8	82%	0.822	77%	0.772	S	S	*	*			trans	99.4	114.2	141.7	5.8	0	0	0	0	120.5
158	L	38.5	Very low	34.4	Very low	165 Å²	165	153.6 Å²	153.6	86%	0.864	78%	0.776	S	S	*	*			trans	-58.4	157.1	157.5	-67.9	164.3	0	0	0	110.9
159	P	38.4	Very low	34.8	Very low	118 Å²	118	157.7 Å²	157.7	77%	0.766	79%	0.787	S	S	*	*				-144.4	154.4	110.4	32.5	-14.8	0	0	0	116.4
160	T	37.5	Very low	34.9	Very low	138 Å²	138	151.5 Å²	151.5	85%	0.847	78%	0.784	S	S	*	*			trans	-35.9	143.3	161	42	0	0	0	0	117.4
161	S	38	Very low	35.2	Very low	106 Å²	106	152.5 Å²	152.5	74%	0.741	79%	0.785	S	S	*	*			trans	-151.7	118	150.1	174.6	0	0	0	0	110.8
162	R	39.6	Very low	35.6	Very low	240 Å²	240	152.2 Å²	152.2	91%	0.906	78%	0.784	S	S	*	*			trans	-96.7	127.1	171.3	-74.6	-178.5	173.6	-157	-1.6	108.3
163	H	34.2	Very low	36	Very low	189 Å²	189	152.2 Å²	152.2	88%	0.875	79%	0.789	S	S	*	*			trans	-136.6	148.6	154.5	-74.8	-42.6	0	0	0	111.4
164	K	34.7	Very low	36.7	Very low	194 Å²	194	152 Å²	152	84%	0.843	79%	0.792	S	S	*	*			trans	-120.5	146.7	-155.1	-164.2	-164.3	-175.3	-168.5	0	108.4
165	C	28.3	Very low	37.4	Very low	113 Å²	113	154.3 Å²	154.3	76%	0.764	80%	0.803	S	S	*	*			trans	71.8	148.3	158.8	-101.2	0	0	0	0	116.9
166	R	32.9	Very low	37.9	Very low	206 Å²	206	158.5 Å²	158.5	78%	0.777	82%	0.816	S	S	*	*			cis	-173.6	147.4	4.8	-177.6	168.6	176.7	179.5	4.5	109.2
167	D	34.7	Very low	38.1	Very low	134 Å²	134	158 Å²	158	72%	0.717	81%	0.814	S	S	*	*			trans	45.5	114.6	156.9	-59.8	-25.6	0	0	0	121.3
168	S	35.9	Very low	38.4	Very low	124 Å²	124	160.4 Å²	160.4	87%	0.867	82%	0.821	S	S	*	*			trans	-143.6	118.4	142.7	59.9	0	0	0	0	110.2
169	R	42.9	Very low	38.5	Very low	246 Å²	246	158.2 Å²	158.2	93%	0.928	82%	0.819	S	S	*	*			trans	-81.7	154.4	173	-75.2	-178.1	178.1	-147	-1.7	110.8
170	A	36.1	Very low	38.5	Very low	98 Å²	98	159.5 Å²	159.5	81%	0.81	81%	0.814	S	S	*	*			trans	99.7	130.6	155.4	0	0	0	0	0	117
171	D	38	Very low	38.5	Very low	136 Å²	136	159.4 Å²	159.4	73%	0.727	81%	0.809	S	S	*	*			trans	68.2	103.4	175.2	-81.5	-12.7	0	0	0	117.3
172	E	43.8	Very low	38.5	Very low	154 Å²	154	162.8 Å²	162.8	72%	0.72	81%	0.813	S	S	*	*				-175	106.8	98.9	-77.6	-52.9	144.6	0	0	107.8	L174	E172-L174 VanDerWaalsContact C-N 3.32Å; E172-L174 PolarHBondContact O-N 2.64Å
173	D	43.7	Very low	38.5	Very low	161 Å²	161	154.8 Å²	154.8	86%	0.861	79%	0.791	S	S	*	*			trans	-68.3	70.5	177.8	-77.2	-37.1	0	0	0	112.7
174	L	45.6	Very low	38.8	Very low	150 Å²	150	149.4 Å²	149.4	79%	0.785	77%	0.774	S	S	*	*			trans	-142.1	22.5	-178.8	-74.6	178.1	0	0	0	117	E172	E172-L174 VanDerWaalsContact C-N 3.32Å; E172-L174 PolarHBondContact O-N 2.64Å
175	I	46.9	Very low	39.3	Very low	174 Å²	174	151.7 Å²	151.7	89%	0.892	78%	0.778	S	S	*	*	S	Bend	trans	-141.1	68.2	170.5	-45.2	-178.6	0	0	0	111.6
176	E	43.3	Very low	40.6	Very low	179 Å²	179	147.5 Å²	147.5	84%	0.836	75%	0.748	S	S	*	*	S	Bend	trans	-140.8	22	165.4	-146.8	175.9	-170.5	0	0	114.3
177	H	35.7	Very low	41.6	Very low	159 Å²	159	144.9 Å²	144.9	74%	0.736	75%	0.749	S	S	*	*			trans	-135.4	36.3	-177.1	-70.9	-58.5	0	0	0	116.2
178	L	38.5	Very low	42.8	Very low	185 Å²	185	139.7 Å²	139.7	97%	0.969	72%	0.721	S	S	*	*	S	Bend	trans	-128.6	34.1	173.9	-78	169.1	0	0	0	114.3
179	S	40.6	Very low	43.7	Very low	118 Å²	118	139.9 Å²	139.9	83%	0.825	71%	0.713	S	S	*	*			trans	-136.4	40.6	162	62.5	0	0	0	0	111.1	D181	S179-D181 PolarHBondContact O-N 3.22Å
180	Q	37.7	Very low	44.5	Very low	145 Å²	145	129.6 Å²	129.6	68%	0.678	68%	0.675	S	S	*	*			trans	-76.2	113.6	155.5	-86.5	178.7	-37.1	0	0	106.8	E182	Q180-E182 PolarHBondContact O-N 3.1Å
181	D	37.7	Very low	45.2	Very low	137 Å²	137	133.5 Å²	133.5	73%	0.733	68%	0.676	S	S	*	*			trans	-54.5	78.1	166.9	-161.6	23.8	0	0	0	108.7	S179 T183	S179-D181 PolarHBondContact O-N 3.22Å; D181-T183 PolarHBondContact O-N 2.98Å; D181-T183 WeakPolarHBondContact OD1-CG2 3.49Å
182	E	36.7	Very low	45.7	Very low	176 Å²	176	134.9 Å²	134.9	82%	0.822	68%	0.678	S	S	*	*			trans	-73.9	46	169.9	-74.3	-86.1	123.8	0	0	109	Q180 S184	Q180-E182 PolarHBondContact O-N 3.1Å; E182-S184 VanDerWaalsContact C-N 3.28Å; E182-S184 PolarHBondContact O-N 2.8Å; E182-S184 VanDerWaalsContact O-N 3.1Å
183	T	39.6	Very low	46.3	Very low	72 Å²	72	129.8 Å²	129.8	44%	0.442	65%	0.652	S	S	.	*			trans	-71.3	98.5	153	56.2	0	0	0	0	105.1	D181 R185	D181-T183 PolarHBondContact O-N 2.98Å; D181-T183 WeakPolarHBondContact OD1-CG2 3.49Å; T183-R185 PolarHBondContact O-N 2.72Å
184	S	42	Very low	46.4	Very low	76 Å²	76	128.6 Å²	128.6	53%	0.531	65%	0.646	S	S	.	*			trans	-10.1	104.5	164.5	53.9	0	0	0	0	111.5	E182 L186	E182-S184 VanDerWaalsContact C-N 3.28Å; E182-S184 PolarHBondContact O-N 2.8Å; E182-S184 VanDerWaalsContact O-N 3.1Å; S184-L186 VanDerWaalsContact C-N 3.34Å; S184-L186 WeakPolarHBondContact O-CD2 3.45Å; S184-L186 PolarHBondContact O-N 2.78Å
185	R	45.5	Very low	46.6	Very low	242 Å²	242	125.7 Å²	125.7	91%	0.913	64%	0.635	S	S	*	*			trans	-55.6	104	174.8	-79.3	174.9	68.8	141.7	-1.5	106.6	T183 D187	T183-R185 PolarHBondContact O-N 2.72Å; R185-D187 PolarHBondContact O-N 2.85Å
186	L	55.5	Low	46.7	Very low	26 Å²	26	122.5 Å²	122.5	14%	0.136	63%	0.634	C	S	.	*			trans	-67.5	104.4	176.9	-58.5	-167.4	0	0	0	106.1	L106 T108 S184 L188	L106-L186 HydrophobicContact CB-CD1 3.87Å; L106-L186 WeakPolarHBondContact O-CD1 3.4Å; T108-L186 WeakPolarHBondContact OG1-CD2 3.5Å; S184-L186 VanDerWaalsContact C-N 3.34Å; S184-L186 WeakPolarHBondContact O-CD2 3.45Å; S184-L186 PolarHBondContact O-N 2.78Å; L186-L188 HydrophobicContact CB-CD1 3.65Å; L186-L188 HydrophobicContact CB-CG 3.88Å; L186-L188 HydrophobicContact CD1-CD1 3.94Å; L186-L188 HydrophobicContact CG-CD1 4.47Å; L186-L188 PolarHBondContact O-N 3.08Å
187	D	52.8	Low	47	Very low	151 Å²	151	116.6 Å²	116.6	81%	0.807	62%	0.621	S	S	*	*			trans	-74.9	68.9	170.2	-157.2	35.2	0	0	0	107.5	R185 D189	R185-D187 PolarHBondContact O-N 2.85Å; D187-D189 PolarHBondContact O-N 3.45Å
188	L	60.2	Low	48.1	Very low	25 Å²	25	110.1 Å²	110.1	13%	0.131	59%	0.592	C	S	.	*			trans	-84.2	102.9	171.7	-71.9	158.8	0	0	0	104.5	M49 L186 F190	M49-L188 HydrophobicContact CE-CD1 3.34Å; M49-L188 HydrophobicContact CE-CD2 3.35Å; M49-L188 HydrophobicContact CE-CG 3.9Å; L186-L188 HydrophobicContact CB-CD1 3.65Å; L186-L188 HydrophobicContact CB-CG 3.88Å; L186-L188 HydrophobicContact CD1-CD1 3.94Å; L186-L188 HydrophobicContact CG-CD1 4.47Å; L186-L188 PolarHBondContact O-N 3.08Å; L188-F190 VanDerWaalsContact C-N 3.28Å; L188-F190 HydrophobicContact CB-CD2 3.83Å; L188-F190 HydrophobicContact CB-CE1 4.15Å; L188-F190 HydrophobicContact CB-CE2 3.31Å; L188-F190 HydrophobicContact CB-CG 4.45Å; L188-F190 HydrophobicContact CB-CZ 3.52Å; L188-F190 HydrophobicContact CD1-CE1 4.37Å; L188-F190 HydrophobicContact CD1-CE2 4.05Å; L188-F190 HydrophobicContact CD1-CZ 3.57Å; L188-F190 HydrophobicContact CG-CE2 4.32Å; L188-F190 HydrophobicContact CG-CZ 4.16Å; L188-F190 WeakPolarHBondContact O-CD2 3.36Å; L188-F190 WeakPolarHBondContact O-CE2 3.11Å; L188-F190 PolarHBondContact O-N 2.87Å
189	D	54.6	Low	49	Very low	127 Å²	127	103 Å²	103	68%	0.679	56%	0.556	S	S	*	*			trans	-63.8	95.3	167.8	-89.4	-28.7	0	0	0	107.9	D187 E191	D187-D189 PolarHBondContact O-N 3.45Å; D189-E191 PolarHBondContact O-N 2.81Å
190	F	60	Low	49.7	Very low	30 Å²	30	103.2 Å²	103.2	13%	0.132	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	15.7	176.7	-63.5	-85.5	0	0	0	112.5	M49 Y99 R103 L188 W193	M49-F190 HydrophobicContact CE-CE1 4.21Å; M49-F190 HydrophobicContact CE-CZ 4.45Å; Y99-F190 AromaticContact CD1-CD1 3.43Å; Y99-F190 HydrophobicContact CD1-CD1 3.43Å; Y99-F190 VanDerWaalsContact CD1-CD1 3.43Å; Y99-F190 AromaticContact CD1-CE1 3.51Å; Y99-F190 HydrophobicContact CD1-CE1 3.51Å; Y99-F190 HydrophobicContact CD1-CG 4.18Å; Y99-F190 HydrophobicContact CD1-CZ 4.3Å; Y99-F190 AromaticContact CE1-CD1 3.51Å; Y99-F190 HydrophobicContact CE1-CD1 3.51Å; Y99-F190 AromaticContact CE1-CE1 3.96Å; Y99-F190 HydrophobicContact CE1-CE1 3.96Å; Y99-F190 HydrophobicContact CE1-CG 4.33Å; Y99-F190 HydrophobicContact CG-CD1 4.21Å; Y99-F190 HydrophobicContact CG-CE1 4.35Å; R103-F190 HydrophobicContact CG-CE2 3.9Å; R103-F190 HydrophobicContact CG-CZ 3.97Å; L188-F190 VanDerWaalsContact C-N 3.28Å; L188-F190 HydrophobicContact CB-CD2 3.83Å; L188-F190 HydrophobicContact CB-CE1 4.15Å; L188-F190 HydrophobicContact CB-CE2 3.31Å; L188-F190 HydrophobicContact CB-CG 4.45Å; L188-F190 HydrophobicContact CB-CZ 3.52Å; L188-F190 HydrophobicContact CD1-CE1 4.37Å; L188-F190 HydrophobicContact CD1-CE2 4.05Å; L188-F190 HydrophobicContact CD1-CZ 3.57Å; L188-F190 HydrophobicContact CG-CE2 4.32Å; L188-F190 HydrophobicContact CG-CZ 4.16Å; L188-F190 WeakPolarHBondContact O-CD2 3.36Å; L188-F190 WeakPolarHBondContact O-CE2 3.11Å; L188-F190 PolarHBondContact O-N 2.87Å; F190-W193 AromaticContact CD1-NE1 3.81Å
191	E	49.7	Very low	51	Low	180 Å²	180	98 Å²	98	84%	0.841	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-20.1	179.5	-158.6	88.6	-169.3	0	0	111.8	D189 W193	D189-E191 PolarHBondContact O-N 2.81Å; E191-W193 VanDerWaalsContact C-N 3.28Å; E191-W193 PolarHBondContact O-N 2.81Å
192	E	49.8	Very low	51.9	Low	166 Å²	166	93 Å²	93	78%	0.776	49%	0.485	S	S	*	.			trans	-86.7	24.3	-176.7	-153.6	-172.8	173.3	0	0	114.3	D194	E192-D194 VanDerWaalsContact C-N 3.3Å
193	W	57.3	Low	52.8	Low	46 Å²	46	87.8 Å²	87.8	17%	0.174	46%	0.463	C	S	.	.			trans	-95.8	17.1	-177.6	-60.8	72.5	0	0	0	112.5	M49 M53 F190 E191 V195 L198 F202	M49-W193 HydrophobicContact CB-CH2 3.78Å; M49-W193 HydrophobicContact CB-CZ2 3.85Å; M49-W193 HydrophobicContact CG-CH2 3.29Å; M49-W193 HydrophobicContact CG-CZ2 3.24Å; M53-W193 HydrophobicContact CB-CH2 4.49Å; M53-W193 HydrophobicContact CB-CZ3 4.01Å; M53-W193 HydrophobicContact CE-CE3 4.05Å; M53-W193 HydrophobicContact CE-CZ3 4.07Å; M53-W193 HydrophobicContact CG-CE3 4.41Å; M53-W193 HydrophobicContact CG-CH2 3.74Å; M53-W193 HydrophobicContact CG-CZ3 3.55Å; F190-W193 AromaticContact CD1-NE1 3.81Å; E191-W193 VanDerWaalsContact C-N 3.28Å; E191-W193 PolarHBondContact O-N 2.81Å; W193-V195 PolarHBondContact O-N 3.29Å; W193-L198 HydrophobicContact CB-CD1 4.22Å; W193-L198 HydrophobicContact CE3-CD1 3.6Å; W193-L198 HydrophobicContact CE3-CD2 4Å; W193-L198 HydrophobicContact CE3-CG 4.45Å; W193-L198 HydrophobicContact CZ3-CD1 4.37Å; W193-L198 HydrophobicContact CZ3-CD2 3.92Å; W193-F202 HydrophobicContact CE3-CZ 4.3Å
194	D	45.5	Very low	53.4	Low	137 Å²	137	86 Å²	86	73%	0.733	46%	0.459	S	S	*	.			trans	-67.2	88.5	-172.8	-155.6	13	0	0	0	111.7	E192 A196	E192-D194 VanDerWaalsContact C-N 3.3Å; D194-A196 VanDerWaalsContact C-N 3.27Å; D194-A196 PolarHBondContact O-N 2.87Å
195	V	49.6	Very low	53.4	Low	89 Å²	89	88.2 Å²	88.2	54%	0.539	47%	0.465	S	S	.	.	S	Bend	trans	65.8	-20.6	138	-177.6	0	0	0	0	119.5	W193 L203	W193-V195 PolarHBondContact O-N 3.29Å; V195-L203 HydrophobicContact CB-CD2 4.16Å; V195-L203 HydrophobicContact CG1-CD2 4.21Å; V195-L203 HydrophobicContact CG2-CD2 3.98Å; V195-L203 VanDerWaalsContact O-CD1 3.23Å; V195-L203 WeakPolarHBondContact O-CD1 2.96Å
196	A	49.2	Very low	53.5	Low	106 Å²	106	80.2 Å²	80.2	88%	0.876	44%	0.439	S	S	*	.	S	Bend	trans	-95.6	-7.7	-169.5	0	0	0	0	0	116.3	D194	D194-A196 VanDerWaalsContact C-N 3.27Å; D194-A196 PolarHBondContact O-N 2.87Å
197	G	49.6	Very low	53.1	Low	55 Å²	55	88.6 Å²	88.6	57%	0.567	47%	0.469	S	S	*	.	S	Bend	trans	-146.4	8.6	-168.3	0	0	0	0	0	117.4
198	L	58.3	Low	52.7	Low	24 Å²	24	88 Å²	88	13%	0.126	47%	0.466	C	S	.	.	S	Bend	trans	-101.3	141.7	-178.9	-64.6	163.4	0	0	0	110.3	W193 F202	W193-L198 HydrophobicContact CB-CD1 4.22Å; W193-L198 HydrophobicContact CE3-CD1 3.6Å; W193-L198 HydrophobicContact CE3-CD2 4Å; W193-L198 HydrophobicContact CE3-CG 4.45Å; W193-L198 HydrophobicContact CZ3-CD1 4.37Å; W193-L198 HydrophobicContact CZ3-CD2 3.92Å; L198-F202 HydrophobicContact CB-CB 3.78Å; L198-F202 HydrophobicContact CB-CD1 3.56Å; L198-F202 HydrophobicContact CB-CE1 4.33Å; L198-F202 HydrophobicContact CB-CG 3.68Å; L198-F202 HydrophobicContact CD1-CD1 3.28Å; L198-F202 HydrophobicContact CD1-CE1 3.16Å; L198-F202 HydrophobicContact CD1-CE2 4.48Å; L198-F202 HydrophobicContact CD1-CG 4.03Å; L198-F202 HydrophobicContact CD1-CZ 3.81Å; L198-F202 HydrophobicContact CG-CD1 4Å; L198-F202 HydrophobicContact CG-CE1 4.28Å; L198-F202 HydrophobicContact CG-CG 4.36Å
199	P	57.6	Low	51.9	Low	34 Å²	34	92.7 Å²	92.7	22%	0.221	49%	0.491	C	S	.	.			trans	-55.6	156.4	-174.6	-26.3	35.7	0	0	0	113.2	W201 F202	P199-W201 HydrophobicContact CB-CD2 4.28Å; P199-W201 HydrophobicContact CB-CZ2 3.68Å; P199-W201 HydrophobicContact CG-CH2 4.29Å; P199-W201 HydrophobicContact CG-CZ2 3.61Å; P199-W201 PolarHBondContact O-N 2.86Å; P199-F202 WeakPolarHBondContact O-CA 2.91Å; P199-F202 WeakPolarHBondContact O-CB 3.12Å; P199-F202 PolarHBondContact O-N 3.4Å
200	W	55.8	Low	51.3	Low	124 Å²	124	91.4 Å²	91.4	47%	0.47	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-47	-33.8	-174.5	65.9	-90.1	0	0	0	115.8	M61 F202	M61-W200 HydrophobicContact CG-CZ2 4.13Å; M61-W200 HydrophobicContact SD-CZ2 3.63Å; W200-F202 PolarHBondContact O-N 2.9Å
201	W	64.3	Low	50.3	Low	36 Å²	36	96.6 Å²	96.6	14%	0.136	52%	0.519	C	S	.	.	G	3₁₀ helix	trans	-76.2	-4.2	178.4	49.3	-104.7	0	0	0	113.4	M53 H54 G57 V92 P199	M53-W201 WeakPolarHBondContact O-CH2 3.35Å; H54-W201 WeakPolarHBondContact O-CZ2 3.37Å; G57-W201 VanDerWaalsContact C-CE2 3.5Å; V92-W201 WeakPolarHBondContact CG1-O 3.42Å; P199-W201 HydrophobicContact CB-CD2 4.28Å; P199-W201 HydrophobicContact CB-CZ2 3.68Å; P199-W201 HydrophobicContact CG-CH2 4.29Å; P199-W201 HydrophobicContact CG-CZ2 3.61Å; P199-W201 PolarHBondContact O-N 2.86Å
202	F	57.4	Low	50	Low	31 Å²	31	92.9 Å²	92.9	14%	0.136	51%	0.51	C	S	.	.	G	3₁₀ helix	trans	-92.1	-26.9	178	-161.1	-91.8	0	0	0	113.4	M53 V92 W193 L198 P199 W200	M53-F202 HydrophobicContact CE-CE2 3.3Å; M53-F202 HydrophobicContact CE-CZ 3.55Å; M53-F202 HydrophobicContact SD-CE2 4.33Å; V92-F202 WeakPolarHBondContact CG1-O 3.42Å; W193-F202 HydrophobicContact CE3-CZ 4.3Å; L198-F202 HydrophobicContact CB-CB 3.78Å; L198-F202 HydrophobicContact CB-CD1 3.56Å; L198-F202 HydrophobicContact CB-CE1 4.33Å; L198-F202 HydrophobicContact CB-CG 3.68Å; L198-F202 HydrophobicContact CD1-CD1 3.28Å; L198-F202 HydrophobicContact CD1-CE1 3.16Å; L198-F202 HydrophobicContact CD1-CE2 4.48Å; L198-F202 HydrophobicContact CD1-CG 4.03Å; L198-F202 HydrophobicContact CD1-CZ 3.81Å; L198-F202 HydrophobicContact CG-CD1 4Å; L198-F202 HydrophobicContact CG-CE1 4.28Å; L198-F202 HydrophobicContact CG-CG 4.36Å; P199-F202 WeakPolarHBondContact O-CA 2.91Å; P199-F202 WeakPolarHBondContact O-CB 3.12Å; P199-F202 PolarHBondContact O-N 3.4Å; W200-F202 PolarHBondContact O-N 2.9Å
203	L	55.6	Low	49.9	Very low	67 Å²	67	93.6 Å²	93.6	35%	0.351	51%	0.511	S	S	.	.	S	Bend	trans	-104.9	12.2	-167.4	-66.9	166.6	0	0	0	114.9	V195 N205	V195-L203 HydrophobicContact CB-CD2 4.16Å; V195-L203 HydrophobicContact CG1-CD2 4.21Å; V195-L203 HydrophobicContact CG2-CD2 3.98Å; V195-L203 VanDerWaalsContact O-CD1 3.23Å; V195-L203 WeakPolarHBondContact O-CD1 2.96Å; L203-N205 PolarHBondContact O-N 2.9Å
204	G	51.5	Low	48.9	Very low	35 Å²	35	96.7 Å²	96.7	36%	0.361	54%	0.539	S	S	.	.			trans	61.9	14.6	165	0	0	0	0	0	116.4
205	N	42.8	Very low	48.9	Very low	122 Å²	122	96.7 Å²	96.7	65%	0.652	54%	0.539	S	S	*	.			trans	-123.1	66.4	-177.1	-142.5	-3.6	0	0	0	111.3	L203 R207	L203-N205 PolarHBondContact O-N 2.9Å; N205-R207 VanDerWaalsContact C-N 3.27Å; N205-R207 PolarHBondContact O-N 3.1Å; N205-R207 VanDerWaalsContact O-N 3.11Å
206	L	47.3	Very low	48.8	Very low	73 Å²	73	95.8 Å²	95.8	38%	0.382	55%	0.548	S	S	.	.			trans	-80.1	81.5	162	-170.7	88.7	0	0	0	109.3	Q71 N208	Q71-L206 HydrophobicContact CB-CB 4.28Å; Q71-L206 HydrophobicContact CB-CD2 4.34Å; Q71-L206 HydrophobicContact CG-CD2 3.69Å; Q71-L206 HydrophobicContact CG-CG 4.5Å; L206-N208 PolarHBondContact O-N 2.75Å
207	R	46.7	Very low	48.4	Very low	203 Å²	203	96.5 Å²	96.5	77%	0.766	55%	0.547	S	S	*	.			trans	-77.9	105.8	153.3	-73.7	-177.9	170.4	-147.9	-2.6	107.4	N205	N205-R207 VanDerWaalsContact C-N 3.27Å; N205-R207 PolarHBondContact O-N 3.1Å; N205-R207 VanDerWaalsContact O-N 3.11Å
208	N	43.3	Very low	48.5	Very low	139 Å²	139	99.9 Å²	99.9	74%	0.743	56%	0.557	S	S	*	*	S	Bend	trans	58.2	81.2	147.6	-52.6	22.1	0	0	0	115.7	L206	L206-N208 PolarHBondContact O-N 2.75Å
209	N	43.6	Very low	48.1	Very low	123 Å²	123	105 Å²	105	66%	0.658	58%	0.584	S	S	*	*			trans	-145.3	56.5	152.7	-85.2	-41.2	0	0	0	111.1
210	C	42	Very low	47.5	Very low	99 Å²	99	111.5 Å²	111.5	67%	0.669	62%	0.616	S	S	*	*			trans	-94.8	87.8	144	-71.2	0	0	0	0	105.7	P212	C210-P212 WeakPolarHBondContact O-CD 3.12Å
211	I	38.8	Very low	47	Very low	140 Å²	140	113.9 Å²	113.9	72%	0.718	63%	0.633	S	S	*	*			trans	-79.9	105.9	154.6	-60.9	175.5	0	0	0	103.8	K213	I211-K213 PolarHBondContact O-N 3.41Å
212	P	43.2	Very low	46.1	Very low	102 Å²	102	117.4 Å²	117.4	66%	0.662	66%	0.658	S	S	*	*			trans	-61.5	127.4	165.5	-8.1	25.7	0	0	0	105.1	C210 S214	C210-P212 WeakPolarHBondContact O-CD 3.12Å; P212-S214 PolarHBondContact O-N 2.86Å
213	K	48.4	Very low	45.2	Very low	180 Å²	180	122.1 Å²	122.1	78%	0.783	69%	0.685	S	S	*	*			trans	-58.4	89.4	166	-171.7	-179.7	175.2	79.3	0	107	I211 N215	I211-K213 PolarHBondContact O-N 3.41Å; K213-N215 VanDerWaalsContact C-N 3.27Å; K213-N215 PolarHBondContact O-N 2.96Å
214	S	36.7	Very low	44.8	Very low	111 Å²	111	127.2 Å²	127.2	78%	0.776	71%	0.707	S	S	*	*			trans	-71.3	88.2	175.1	51.2	0	0	0	0	107.8	P212 G216	P212-S214 PolarHBondContact O-N 2.86Å; S214-G216 VanDerWaalsContact C-N 3.34Å; S214-G216 PolarHBondContact O-N 3.03Å; S214-G216 VanDerWaalsContact O-N 3.11Å
215	N	44.7	Very low	44.5	Very low	137 Å²	137	132.6 Å²	132.6	73%	0.733	73%	0.727	S	S	*	*			trans	-75.1	94.3	162.1	-82.2	18	0	0	0	108	K213	K213-N215 VanDerWaalsContact C-N 3.27Å; K213-N215 PolarHBondContact O-N 2.96Å
216	G	48.2	Very low	44.8	Very low	71 Å²	71	134.8 Å²	134.8	73%	0.732	74%	0.737	S	S	*	*			trans	80.1	108.1	152	0	0	0	0	0	117.4	S214	S214-G216 VanDerWaalsContact C-N 3.34Å; S214-G216 PolarHBondContact O-N 3.03Å; S214-G216 VanDerWaalsContact O-N 3.11Å
217	S	41.3	Very low	45.2	Very low	120 Å²	120	134.8 Å²	134.8	84%	0.839	76%	0.755	S	S	*	*				-159.6	132.6	129	-169.2	0	0	0	0	109.7
218	T	50.9	Low	45.6	Very low	126 Å²	126	131.7 Å²	131.7	77%	0.773	76%	0.759	S	S	*	*			trans	-65.4	148.7	-179.8	40	0	0	0	0	113.4
219	D	49.4	Very low	46.1	Very low	131 Å²	131	128.9 Å²	128.9	70%	0.701	76%	0.755	S	S	*	*			trans	38	107.6	136.2	-169.9	35.9	0	0	0	118
220	L	45.3	Very low	46.6	Very low	172 Å²	172	131.2 Å²	131.2	90%	0.901	77%	0.766	S	S	*	*			trans	-147.8	112.1	137.8	-80	-174.6	0	0	0	110.6
221	Q	46.7	Very low	47.2	Very low	174 Å²	174	132.9 Å²	132.9	81%	0.813	77%	0.772	S	S	*	*			trans	-75.5	131.2	168.2	-179.8	164	7.6	0	0	111.5
222	T	44.4	Very low	47.7	Very low	110 Å²	110	130.6 Å²	130.6	68%	0.675	77%	0.769	S	S	*	*			trans	-172.1	107.1	150	160.2	0	0	0	0	114
223	N	39.2	Very low	48.1	Very low	129 Å²	129	133.6 Å²	133.6	69%	0.69	78%	0.779	S	S	*	*			trans	55	136.5	132.5	-53.4	-67.5	0	0	0	119
224	Q	46	Very low	48.3	Very low	175 Å²	175	131.2 Å²	131.2	82%	0.818	78%	0.78	S	S	*	*			cis	-171.8	149.6	42.6	-136.6	159.9	67.1	0	0	110.4
225	D	45.6	Very low	49.4	Very low	147 Å²	147	132.1 Å²	132.1	79%	0.786	78%	0.781	S	S	*	*			trans	-50.5	138.5	179.7	-63.5	-75	0	0	0	116.5
226	I	49.2	Very low	49.9	Very low	168 Å²	168	131.2 Å²	131.2	86%	0.862	78%	0.776	S	S	*	*			trans	-160.1	116.8	131.8	-107.2	141.3	0	0	0	109.7
227	G	56.4	Low	50.3	Low	74 Å²	74	135.1 Å²	135.1	76%	0.763	78%	0.78	S	S	*	*			trans	-70.8	143.6	-169.4	0	0	0	0	0	114
228	T	54.4	Low	51	Low	137 Å²	137	136.6 Å²	136.6	84%	0.84	78%	0.778	S	S	*	*			trans	-150.6	112.8	156.6	-62.6	0	0	0	0	109
229	A	52.9	Low	51.5	Low	81 Å²	81	139.8 Å²	139.8	67%	0.669	78%	0.776	S	S	*	*			trans	43.9	111.3	158.7	0	0	0	0	0	120	V231	A229-V231 HydrophobicContact CB-CG2 4.39Å; A229-V231 PolarHBondContact O-N 2.78Å
230	I	54.5	Low	51.2	Low	171 Å²	171	143 Å²	143	88%	0.877	79%	0.785	S	S	*	*			trans	-65.3	121	151	-59.1	176.7	0	0	0	107.2
231	V	54.3	Low	51.2	Low	134 Å²	134	141.8 Å²	141.8	81%	0.812	78%	0.778	S	S	*	*			trans	-118.4	127.2	165.4	179.4	0	0	0	0	108.1	A229	A229-V231 HydrophobicContact CB-CG2 4.39Å; A229-V231 PolarHBondContact O-N 2.78Å
232	S	49.7	Very low	51.3	Low	93 Å²	93	140.2 Å²	140.2	65%	0.65	78%	0.775	S	S	*	*			trans	-65.6	154.2	-164.9	-51.3	0	0	0	0	115.6	T234	S232-T234 PolarHBondContact O-N 2.95Å
233	D	51.5	Low	51.4	Low	164 Å²	164	141.8 Å²	141.8	88%	0.877	78%	0.775	S	S	*	*			trans	1.3	105.2	137.9	-76.8	-32.1	0	0	0	115.1
234	T	54	Low	52	Low	131 Å²	131	141.3 Å²	141.3	80%	0.804	78%	0.777	S	S	*	*			trans	-121.2	101.1	143.8	60.7	0	0	0	0	107.2	S232 D236	S232-T234 PolarHBondContact O-N 2.95Å; T234-D236 PolarHBondContact O-N 2.93Å
235	T	58.3	Low	51.7	Low	129 Å²	129	137.8 Å²	137.8	79%	0.791	77%	0.767	S	S	*	*			trans	-31.1	120.5	148.5	-175.4	0	0	0	0	110.2
236	D	55.9	Low	51.6	Low	118 Å²	118	136.7 Å²	136.7	63%	0.631	77%	0.771	S	S	*	*			trans	175	73.8	132.3	-155.5	26.2	0	0	0	109.7	T234	T234-D236 PolarHBondContact O-N 2.93Å
237	D	56.3	Low	51.5	Low	153 Å²	153	137.3 Å²	137.3	82%	0.818	77%	0.77	S	S	*	*			trans	-141.7	53.1	165.5	-82	-42.2	0	0	0	109.4	W239	D237-W239 VanDerWaalsContact C-N 3.29Å; D237-W239 PolarHBondContact O-N 2.87Å
238	L	55.3	Low	50.9	Low	151 Å²	151	142.8 Å²	142.8	79%	0.791	78%	0.776	S	S	*	*			trans	-91.8	59.6	166.9	-68.8	179.9	0	0	0	110.4
239	W	61.3	Low	50.1	Low	193 Å²	193	144.8 Å²	144.8	73%	0.731	78%	0.78	S	S	*	*			trans	-105.4	8.9	179.5	-79.4	102.3	0	0	0	116	D237	D237-W239 VanDerWaalsContact C-N 3.29Å; D237-W239 PolarHBondContact O-N 2.87Å
240	F	43	Very low	49.6	Very low	200 Å²	200	144.5 Å²	144.5	88%	0.877	79%	0.785	S	S	*	*	S	Bend	trans	-146.1	66.4	169.3	-69	-77.5	0	0	0	113.3
241	L	45.3	Very low	49	Very low	145 Å²	145	142.5 Å²	142.5	76%	0.759	78%	0.781	S	S	*	*			trans	-141.4	74.7	150.2	-71	-179.8	0	0	0	109.6	E243	L241-E243 PolarHBondContact O-N 2.87Å
242	N	50.1	Low	48.3	Very low	141 Å²	141	140 Å²	140	75%	0.754	78%	0.782	S	S	*	*			trans	-84.8	64	148.5	-170.7	50.7	0	0	0	108.1	T244	N242-T244 PolarHBondContact O-N 2.7Å
243	E	46.3	Very low	48.1	Very low	144 Å²	144	142.4 Å²	142.4	67%	0.673	79%	0.786	S	S	*	*			trans	-80.1	95	161.7	-175.2	173.7	-169.2	0	0	106.3	L241 V245	L241-E243 PolarHBondContact O-N 2.87Å; E243-V245 HydrophobicContact CG-CG2 4.46Å; E243-V245 PolarHBondContact O-N 3.1Å
244	T	50.5	Low	47.6	Very low	118 Å²	118	142.8 Å²	142.8	72%	0.724	78%	0.78	S	S	*	*			trans	-85.7	88.7	170.4	34.3	0	0	0	0	108.8	N242	N242-T244 PolarHBondContact O-N 2.7Å
245	V	40.8	Very low	47.1	Very low	102 Å²	102	143.1 Å²	143.1	62%	0.618	78%	0.781	S	S	*	*			trans	-99.9	112.9	148.9	177.4	0	0	0	0	107.4	E243	E243-V245 HydrophobicContact CG-CG2 4.46Å; E243-V245 PolarHBondContact O-N 3.1Å
246	S	43.7	Very low	46.1	Very low	123 Å²	123	144.3 Å²	144.3	86%	0.86	78%	0.778	S	S	*	*			trans	-140.3	103.9	148.6	-91.6	0	0	0	0	108.5
247	E	45.9	Very low	45.4	Very low	182 Å²	182	143.3 Å²	143.3	85%	0.85	79%	0.786	S	S	*	*			trans	-58.6	152.3	161	-65.9	178.9	133.6	0	0	110.9
248	Q	44	Very low	44.3	Very low	189 Å²	189	140.9 Å²	140.9	88%	0.883	79%	0.787	S	S	*	*			trans	122	83.3	146.6	-161.1	152.1	60.3	0	0	115.8
249	L	37.6	Very low	43.2	Very low	178 Å²	178	140.5 Å²	140.5	93%	0.932	79%	0.786	S	S	*	*			trans	-144.5	122.3	138.8	-150.8	76.5	0	0	0	109.7
250	G	42.6	Very low	41.9	Very low	75 Å²	75	135.3 Å²	135.3	77%	0.773	78%	0.779	S	S	*	*			trans	-71.4	143.2	-164.7	0	0	0	0	0	115.4
251	V	41.5	Very low	41.6	Very low	129 Å²	129	133.4 Å²	133.4	78%	0.782	77%	0.773	S	S	*	*			trans	-127.7	109.3	153.3	176.7	0	0	0	0	106.5	I253	V251-I253 PolarHBondContact O-N 3.06Å
252	G	40.7	Very low	41.2	Very low	81 Å²	81	134.8 Å²	134.8	84%	0.835	78%	0.776	S	S	*	*			trans	-64.2	119.1	174.7	0	0	0	0	0	110.3
253	I	44.8	Very low	40.2	Very low	145 Å²	145	133.6 Å²	133.6	74%	0.744	77%	0.774	S	S	*	*			trans	-110.6	108.7	164	-62.2	176.1	0	0	0	106.8	V251 V255	V251-I253 PolarHBondContact O-N 3.06Å; I253-V255 PolarHBondContact O-N 3.07Å
254	K	42.6	Very low	39.8	Very low	172 Å²	172	131.7 Å²	131.7	75%	0.748	78%	0.776	S	S	*	*			trans	-65	113.7	175.6	176.7	-174.6	165.4	-154.3	0	108.9	E256	K254-E256 WeakPolarHBondContact CE-OE2 3.43Å; K254-E256 IonicContact NZ-OE2 2.6Å; K254-E256 PolarHBondContact NZ-OE2 2.79Å
255	V	43.1	Very low	39	Very low	138 Å²	138	134.6 Å²	134.6	84%	0.836	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-100.2	116.8	165.5	171.7	0	0	0	0	107.9	I253	I253-V255 PolarHBondContact O-N 3.07Å
256	E	36.9	Very low	38.7	Very low	154 Å²	154	136 Å²	136	72%	0.72	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-93.4	138.2	176.3	-158.9	171.2	139.8	0	0	109.2	K254	K254-E256 WeakPolarHBondContact CE-OE2 3.43Å; K254-E256 IonicContact NZ-OE2 2.6Å; K254-E256 PolarHBondContact NZ-OE2 2.79Å
257	A	40.7	Very low	38.3	Very low	96 Å²	96	133.8 Å²	133.8	79%	0.793	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-75.2	148.6	-172.4	0	0	0	0	0	113.4
258	A	34.5	Very low	38.2	Very low	103 Å²	103	134.4 Å²	134.4	85%	0.851	79%	0.787	S	S	*	*			trans	-146.3	109.3	151.3	0	0	0	0	0	111.1
259	N	31.9	Very low	37.8	Very low	143 Å²	143	131.8 Å²	131.8	77%	0.765	78%	0.784	S	S	*	*			trans	-16.8	157.8	156.6	-176.1	32.6	0	0	0	121.1
260	S	33.9	Very low	37.8	Very low	84 Å²	84	127.3 Å²	127.3	59%	0.587	77%	0.767	S	S	*	*			trans	104.2	99.8	140.5	-153.4	0	0	0	0	113.9
261	E	35.3	Very low	37.7	Very low	160 Å²	160	130.9 Å²	130.9	75%	0.748	77%	0.769	S	S	*	*				100.7	152.3	74.3	-87.9	173.7	122.5	0	0	112
262	Q	38.8	Very low	38.3	Very low	174 Å²	174	133.7 Å²	133.7	81%	0.813	77%	0.77	S	S	*	*			trans	82.6	107.3	165.5	-73	-169.7	-22.3	0	0	117.9
263	T	28.6	Very low	38.5	Very low	116 Å²	116	137.9 Å²	137.9	71%	0.712	77%	0.765	S	S	*	*				90	140.4	59.5	59	0	0	0	0	114.2
264	S	36.9	Very low	38.1	Very low	104 Å²	104	136 Å²	136	73%	0.727	76%	0.761	S	S	*	*			trans	78.2	111.3	166.3	67.5	0	0	0	0	116
265	E	34.3	Very low	38.1	Very low	178 Å²	178	133.9 Å²	133.9	83%	0.832	76%	0.762	S	S	*	*				64.2	117.4	76.4	-152.3	-163.8	160.6	0	0	109.3
266	V	35.3	Very low	37.9	Very low	132 Å²	132	135.4 Å²	135.4	80%	0.8	76%	0.76	S	S	*	*				175.7	145.9	88.1	162.7	0	0	0	0	107
267	G	35.2	Very low	38	Very low	77 Å²	77	133.3 Å²	133.3	79%	0.794	76%	0.758	S	S	*	*			trans	128.9	91.9	143	0	0	0	0	0	116.6
268	K	42.5	Very low	37.9	Very low	195 Å²	195	132 Å²	132	85%	0.848	75%	0.753	S	S	*	*			trans	-96.4	168.5	175	-160.2	174	-174.1	174.7	0	109.4
269	T	35.3	Very low	38.4	Very low	133 Å²	133	135.8 Å²	135.8	82%	0.816	75%	0.751	S	S	*	*			trans	88	149.7	160.9	81.2	0	0	0	0	116.2
270	S	39	Very low	39	Very low	84 Å²	84	134.5 Å²	134.5	59%	0.587	74%	0.744	S	S	*	*			cis	170.1	122.5	-17.9	160.4	0	0	0	0	105.2
271	N	40.7	Very low	39.5	Very low	150 Å²	150	137.3 Å²	137.3	80%	0.802	75%	0.752	S	S	*	*			trans	44	133.1	139.4	-23.7	-18.6	0	0	0	120.9
272	K	52.9	Low	40.2	Very low	189 Å²	189	135.8 Å²	135.8	82%	0.822	75%	0.749	S	S	*	*				129.7	123.5	116.6	-163.9	177.5	68.3	176.9	0	117.4
273	K	44.9	Very low	41	Very low	168 Å²	168	133.7 Å²	133.7	73%	0.73	74%	0.743	S	S	*	*				117.2	119	128.7	-117.6	-163	167.5	-167.2	0	121.4
274	T	37.1	Very low	42.1	Very low	105 Å²	105	135.9 Å²	135.9	64%	0.644	75%	0.745	S	S	*	*				59	133.1	128.8	44.6	0	0	0	0	124
275	V	42.5	Very low	42.7	Very low	129 Å²	129	136.3 Å²	136.3	78%	0.782	74%	0.739	S	S	*	*				167.5	111.5	111	155.4	0	0	0	0	106.8
276	E	37.9	Very low	44	Very low	170 Å²	170	133.6 Å²	133.6	79%	0.794	74%	0.74	S	S	*	*				82.1	132.3	72	-142.2	-146.3	168.3	0	0	116
277	V	39.5	Very low	45	Very low	110 Å²	110	137.7 Å²	137.7	67%	0.667	74%	0.741	S	S	*	*			trans	93	121.1	149.5	-160.9	0	0	0	0	121.9
278	G	38.8	Very low	46	Very low	68 Å²	68	139.4 Å²	139.4	70%	0.701	74%	0.74	S	S	*	*			trans	146	81	156.4	0	0	0	0	0	110.4
279	K	44.1	Very low	46.5	Very low	183 Å²	183	138.4 Å²	138.4	80%	0.796	74%	0.744	S	S	*	*				51.4	125.5	63.8	-70.6	-164.5	169.8	175.3	0	111.7
280	D	45.8	Very low	47.5	Very low	116 Å²	116	137.8 Å²	137.8	62%	0.62	75%	0.745	S	S	*	*			cis	-166.4	142	16.3	-111.3	-134.5	0	0	0	104.3
281	D	45	Very low	48.3	Very low	142 Å²	142	140.9 Å²	140.9	76%	0.759	76%	0.755	S	S	*	*				62	138.5	100.8	-71.3	-33.5	0	0	0	114.1
282	D	49.7	Very low	48.9	Very low	128 Å²	128	139.9 Å²	139.9	68%	0.684	75%	0.749	S	S	*	*			cis	172.6	175.3	11.4	177	22.7	0	0	0	106.2
283	L	55.4	Low	49	Very low	130 Å²	130	137.5 Å²	137.5	68%	0.681	75%	0.751	S	S	*	*			trans	93.3	100	152.4	-53.7	179.9	0	0	0	121.5
284	E	51.2	Low	49.5	Very low	163 Å²	163	136.3 Å²	136.3	76%	0.762	75%	0.752	S	S	*	*				71.2	124.5	111	-72.5	-71	135.7	0	0	121.4
285	D	49.3	Very low	50.3	Low	112 Å²	112	137 Å²	137	60%	0.599	76%	0.756	S	S	*	*			trans	77.5	110.1	134.4	-145.2	8.3	0	0	0	119.3	R287	D285-R287 PolarHBondContact OD1-N 2.89Å
286	S	62.6	Low	50.6	Low	121 Å²	121	138.4 Å²	138.4	85%	0.846	75%	0.754	S	S	*	*			trans	-153.7	85.1	139	-73.7	0	0	0	0	109.4
287	R	55.7	Low	51	Low	219 Å²	219	137.4 Å²	137.4	83%	0.826	75%	0.753	S	S	*	*			trans	-44	131.9	147.5	-75	176.1	170.5	-173.6	-1.6	111.3	D285	D285-R287 PolarHBondContact OD1-N 2.89Å
288	S	55.8	Low	51.4	Low	112 Å²	112	137.3 Å²	137.3	78%	0.783	75%	0.753	S	S	*	*			trans	-166.7	96.2	150.5	-70.8	0	0	0	0	106.1
289	L	54.1	Low	52	Low	175 Å²	175	138.4 Å²	138.4	92%	0.916	75%	0.75	S	S	*	*				46.5	93.4	82	-77.7	174.5	0	0	0	114.4
290	S	56.3	Low	52.3	Low	120 Å²	120	138.3 Å²	138.3	84%	0.839	75%	0.753	S	S	*	*			trans	-175	140.6	143.1	59.9	0	0	0	0	108
291	D	55.4	Low	52.1	Low	149 Å²	149	140.9 Å²	140.9	80%	0.797	76%	0.763	S	S	*	*			cis	-171.4	145.7	-16.9	-174.7	15.2	0	0	0	102.3	T293	D291-T293 PolarHBondContact O-N 3.41Å
292	D	52.7	Low	52.1	Low	129 Å²	129	140.4 Å²	140.4	69%	0.69	76%	0.76	S	S	*	*			trans	-58.4	129.6	-179.7	-81.7	-39.4	0	0	0	111.2
293	T	55.8	Low	51.8	Low	138 Å²	138	140.6 Å²	140.6	85%	0.847	77%	0.77	S	S	*	*			trans	-131.8	79	145.4	42.8	0	0	0	0	109.3	D291	D291-T293 PolarHBondContact O-N 3.41Å
294	D	54.1	Low	51.1	Low	143 Å²	143	140.2 Å²	140.2	77%	0.765	78%	0.778	S	S	*	*			trans	-63.9	119.3	143.1	-72.6	-33.6	0	0	0	108.2
295	V	55.2	Low	50.6	Low	119 Å²	119	141.6 Å²	141.6	72%	0.721	78%	0.776	S	S	*	*			trans	-128.7	63.8	155.9	80.3	0	0	0	0	109	L297	V295-L297 VanDerWaalsContact C-N 3.31Å; V295-L297 HydrophobicContact CG2-CD1 4.14Å; V295-L297 HydrophobicContact CG2-CG 3.85Å; V295-L297 PolarHBondContact O-N 2.88Å
296	E	48.2	Very low	50.1	Low	160 Å²	160	139.8 Å²	139.8	75%	0.748	78%	0.784	S	S	*	*			trans	-68.7	97.8	144.9	-77.7	-129	137.3	0	0	107.6	T298	E296-T298 VanDerWaalsContact C-N 3.29Å; E296-T298 PolarHBondContact O-N 3.18Å
297	L	45.4	Very low	49.3	Very low	148 Å²	148	143 Å²	143	78%	0.775	78%	0.777	S	S	*	*			trans	-92.6	76.7	153.5	-72.5	176.9	0	0	0	107.9	V295 S299	V295-L297 VanDerWaalsContact C-N 3.31Å; V295-L297 HydrophobicContact CG2-CD1 4.14Å; V295-L297 HydrophobicContact CG2-CG 3.85Å; V295-L297 PolarHBondContact O-N 2.88Å; L297-S299 PolarHBondContact O-N 3.18Å
298	T	49	Very low	48.9	Very low	108 Å²	108	141.6 Å²	141.6	66%	0.663	78%	0.78	S	S	*	*			trans	-72	98.6	147.2	44.9	0	0	0	0	107.2	E296	E296-T298 VanDerWaalsContact C-N 3.29Å; E296-T298 PolarHBondContact O-N 3.18Å
299	S	50.9	Low	48.1	Very low	92 Å²	92	143.9 Å²	143.9	64%	0.643	78%	0.778	S	S	*	*			trans	-157.7	93.2	156.8	-76.7	0	0	0	0	108.9	L297 M301	L297-S299 PolarHBondContact O-N 3.18Å; S299-M301 PolarHBondContact O-N 2.94Å
300	E	50.4	Low	47.3	Very low	180 Å²	180	143.1 Å²	143.1	84%	0.841	77%	0.767	S	S	*	*			trans	0.8	111.6	134.2	62.6	-162.3	164.6	0	0	115.7
301	M	41.8	Very low	46.7	Very low	171 Å²	171	145.3 Å²	145.3	84%	0.842	76%	0.764	S	S	*	*			trans	-146.7	89.6	139.8	-121.8	-148.2	161.1	0	0	111	S299	S299-M301 PolarHBondContact O-N 2.94Å
302	L	45.7	Very low	46.6	Very low	132 Å²	132	143 Å²	143	69%	0.691	76%	0.757	S	S	*	*				49.6	104.4	125.2	-66	166.8	0	0	0	117	S304	L302-S304 PolarHBondContact O-N 3.23Å
303	C	41.7	Very low	46.2	Very low	132 Å²	132	148.3 Å²	148.3	89%	0.892	77%	0.767	S	S	*	*			trans	-17.7	95.9	133.4	-86.9	0	0	0	0	113.2	R305	C303-R305 VanDerWaalsContact C-N 3.28Å; C303-R305 PolarHBondContact O-N 3.46Å
304	S	41.9	Very low	45.9	Very low	122 Å²	122	150.5 Å²	150.5	85%	0.853	77%	0.768	S	S	*	*			trans	-88.3	80.4	160.7	-69.5	0	0	0	0	108.8	L302 G306	L302-S304 PolarHBondContact O-N 3.23Å; S304-G306 PolarHBondContact O-N 3.45Å
305	R	39.7	Very low	45.5	Very low	192 Å²	192	147.3 Å²	147.3	73%	0.725	77%	0.769	S	S	*	*			trans	-64.3	84.5	157.7	179.7	161.4	162.1	164.5	-11.7	108.3	C303 R307	C303-R305 VanDerWaalsContact C-N 3.28Å; C303-R305 PolarHBondContact O-N 3.46Å; R305-R307 VanDerWaalsContact NH2-NH2 3.14Å; R305-R307 PolarHBondContact O-N 3.27Å
306	G	39.2	Very low	45.3	Very low	73 Å²	73	148.9 Å²	148.9	75%	0.753	77%	0.772	S	S	*	*			trans	-85.6	76.7	168	0	0	0	0	0	111.1	S304	S304-G306 PolarHBondContact O-N 3.45Å
307	R	45.5	Very low	45.2	Very low	189 Å²	189	150.6 Å²	150.6	71%	0.713	78%	0.777	S	S	*	*			trans	-75.3	116.9	153.2	-76.8	-173.9	-158.3	-179.8	1.9	106.6	R305	R305-R307 VanDerWaalsContact NH2-NH2 3.14Å; R305-R307 PolarHBondContact O-N 3.27Å
308	H	48.4	Very low	45.5	Very low	190 Å²	190	156.6 Å²	156.6	88%	0.88	80%	0.797	S	S	*	*			trans	-119.7	126.4	152.4	-106	-88.9	0	0	0	110.5
309	H	39.8	Very low	45.3	Very low	159 Å²	159	159.1 Å²	159.1	74%	0.736	80%	0.804	S	S	*	*			trans	-34	138.1	176.2	-97	-94.5	0	0	0	119.2
310	F	35.8	Very low	45	Very low	160 Å²	160	162.6 Å²	162.6	70%	0.702	81%	0.812	S	S	*	*				47.7	114.4	119	-99.7	-95.1	0	0	0	119.4
311	H	44.3	Very low	44.7	Very low	166 Å²	166	161.6 Å²	161.6	77%	0.769	81%	0.811	S	S	*	*				-176.3	161.7	86.8	-110.9	-78.9	0	0	0	111.1
312	P	52.7	Low	44.8	Very low	101 Å²	101	161.1 Å²	161.1	66%	0.656	81%	0.809	S	S	*	*			trans	-98.2	163.9	-158.5	40.5	-36.8	0	0	0	113.6
313	R	45.7	Very low	44.8	Very low	239 Å²	239	162.9 Å²	162.9	90%	0.902	82%	0.816	S	S	*	*			trans	-130.6	106.2	151.6	-84.6	-167.4	176.4	-154.4	-1.2	110.1
314	E	49.5	Very low	45	Very low	184 Å²	184	164.9 Å²	164.9	86%	0.86	81%	0.811	S	S	*	*			trans	27.9	121.7	130.8	-63.6	-179.3	154.9	0	0	117.9
315	G	45.3	Very low	45.2	Very low	76 Å²	76	168 Å²	168	78%	0.784	81%	0.808	S	S	*	*			trans	-68.3	157.5	169.5	0	0	0	0	0	113.3
316	I	51	Low	45.7	Very low	153 Å²	153	166.2 Å²	166.2	79%	0.785	82%	0.815	S	S	*	*			trans	-136.1	121.7	156.8	-64.6	-178.2	0	0	0	107.1	F318	I316-F318 HydrophobicContact CG2-CD2 4.14Å; I316-F318 HydrophobicContact CG2-CE2 3.98Å
317	K	45.8	Very low	46.2	Very low	195 Å²	195	173.9 Å²	173.9	85%	0.848	82%	0.82	S	S	*	*			trans	-59.6	138.3	164.1	-67.4	168.9	173.9	175.3	0	109.7
318	F	50.7	Low	46.3	Very low	275 Å²	275	172.5 Å²	172.5	100%	1.206	83%	0.83	S	S	*	*			trans	-145.7	0	133.1	-83.5	-73	0	0	0	108.3	I316	I316-F318 HydrophobicContact CG2-CD2 4.14Å; I316-F318 HydrophobicContact CG2-CE2 3.98Å

Retrieved 318 of 318 residues in 59.8 ms (Link to these results)

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