A0A5K4FBS2_SCHMA Loading...

BRCT domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBS2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 208 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	43.7	Very low	41.4	Very low	242 Å²	242	138.5 Å²	138.5	100%	1.192	82%	0.823	S	S	*	*				0	100.2	0	-74.1	179.6	144.8	0	0	107.1
2	S	44.9	Very low	41.3	Very low	129 Å²	129	142.1 Å²	142.1	90%	0.902	83%	0.825	S	S	*	*			trans	-98.3	113.3	-173.2	-56.3	0	0	0	0	109.5
3	T	49.2	Very low	41.5	Very low	133 Å²	133	140.4 Å²	140.4	82%	0.816	82%	0.818	S	S	*	*			trans	-87.3	117	172.2	42.2	0	0	0	0	108.8
4	N	39.1	Very low	41.4	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	82%	0.823	S	S	*	*			trans	-102.2	99.1	179.6	-161.8	8	0	0	0	108.7
5	S	41.9	Very low	41.3	Very low	101 Å²	101	146.7 Å²	146.7	71%	0.706	82%	0.821	S	S	*	*			trans	-98	91.2	178.4	-60.7	0	0	0	0	109.5	S7	S5-S7 PolarHBondContact O-N 3.39Å
6	N	38	Very low	41.2	Very low	144 Å²	144	149 Å²	149	77%	0.77	82%	0.823	S	S	*	*			trans	-61.6	111.6	171.7	-101.5	-12.7	0	0	0	110.2
7	S	42.2	Very low	41.5	Very low	113 Å²	113	146.4 Å²	146.4	79%	0.79	81%	0.812	S	S	*	*			trans	-91.3	109.2	172.1	5.7	0	0	0	0	108.6	S5 S9	S5-S7 PolarHBondContact O-N 3.39Å; S7-S9 PolarHBondContact O-N 2.91Å; S7-S9 VanDerWaalsContact O-N 3.13Å
8	N	38	Very low	41.9	Very low	160 Å²	160	145.7 Å²	145.7	86%	0.856	81%	0.805	S	S	*	*			trans	-66.1	108.7	175.5	-73.4	-23.7	0	0	0	109.8	S10	N8-S10 PolarHBondContact O-N 3.24Å
9	S	37.9	Very low	42	Very low	104 Å²	104	146.3 Å²	146.3	73%	0.727	80%	0.801	S	S	*	*			trans	-68.9	116.9	173.9	-179.9	0	0	0	0	110.2	S7 N11	S7-S9 PolarHBondContact O-N 2.91Å; S7-S9 VanDerWaalsContact O-N 3.13Å; S9-N11 PolarHBondContact O-N 2.79Å
10	S	40.6	Very low	41.9	Very low	102 Å²	102	146.6 Å²	146.6	71%	0.713	80%	0.802	S	S	*	*			trans	-72.1	109.1	176.1	-176.8	0	0	0	0	109.9	N8 Q12	N8-S10 PolarHBondContact O-N 3.24Å; S10-Q12 PolarHBondContact O-N 3.02Å
11	N	39.8	Very low	41.9	Very low	148 Å²	148	148.7 Å²	148.7	79%	0.791	80%	0.803	S	S	*	*			trans	-67.2	97.5	175.6	-73.4	-35.9	0	0	0	110	S9 V13	S9-N11 PolarHBondContact O-N 2.79Å; N11-V13 PolarHBondContact O-N 3.1Å
12	Q	40	Very low	41.8	Very low	181 Å²	181	148.1 Å²	148.1	85%	0.846	79%	0.788	S	S	*	*			trans	-72.5	114.2	170.4	-67.4	-130.7	4.1	0	0	110.1	S10 K14	S10-Q12 PolarHBondContact O-N 3.02Å; Q12-K14 PolarHBondContact O-N 2.84Å
13	V	44.8	Very low	41.5	Very low	120 Å²	120	148.1 Å²	148.1	73%	0.727	78%	0.782	S	S	*	*			trans	-73	108.7	175.2	177.7	0	0	0	0	108.6	N11 H15	N11-V13 PolarHBondContact O-N 3.1Å; V13-H15 PolarHBondContact O-N 3.43Å
14	K	39.2	Very low	41	Very low	204 Å²	204	151 Å²	151	89%	0.887	78%	0.784	S	S	*	*			trans	-79.2	109.3	-178.8	-159.8	172.3	-174.2	177.8	0	109.6	Q12 Q16	Q12-K14 PolarHBondContact O-N 2.84Å; K14-Q16 PolarHBondContact O-N 3.5Å
15	H	40.3	Very low	40.9	Very low	172 Å²	172	149.9 Å²	149.9	80%	0.796	78%	0.782	S	S	*	*			trans	-69.8	121.2	173.6	-70.3	-86.1	0	0	0	110.2	V13	V13-H15 PolarHBondContact O-N 3.43Å
16	Q	40.1	Very low	40.8	Very low	183 Å²	183	150.6 Å²	150.6	86%	0.855	79%	0.785	S	S	*	*			trans	-93	111.8	177.6	-162.8	170.7	38.2	0	0	109.6	K14	K14-Q16 PolarHBondContact O-N 3.5Å
17	T	46.6	Very low	40.7	Very low	105 Å²	105	150.7 Å²	150.7	64%	0.644	79%	0.79	S	S	*	*			trans	-78.8	116.1	177.8	-56.2	0	0	0	0	110.2
18	I	48.7	Very low	40.5	Very low	134 Å²	134	151.5 Å²	151.5	69%	0.687	79%	0.791	S	S	*	*			trans	-89.8	111.5	178.2	-58	173.5	0	0	0	109	N20	I18-N20 PolarHBondContact O-N 3.45Å
19	H	42.2	Very low	40.7	Very low	157 Å²	157	148.6 Å²	148.6	73%	0.727	78%	0.783	S	S	*	*			trans	-86.7	96.6	174.1	-68.7	-73.8	0	0	0	110.6	K21	H19-K21 PolarHBondContact O-N 3.48Å
20	N	41.7	Very low	40.7	Very low	151 Å²	151	154.6 Å²	154.6	81%	0.807	79%	0.79	S	S	*	*			trans	-71.4	98.8	171.6	-76.7	-21.2	0	0	0	110.2	I18 R22	I18-N20 PolarHBondContact O-N 3.45Å; N20-R22 PolarHBondContact O-N 2.9Å
21	K	41.5	Very low	40.5	Very low	191 Å²	191	155.3 Å²	155.3	83%	0.83	79%	0.79	S	S	*	*			trans	-75.5	111.4	170.1	-69.4	-171.9	179.2	-177.2	0	109.1	H19 T23	H19-K21 PolarHBondContact O-N 3.48Å; K21-T23 PolarHBondContact O-N 3.03Å
22	R	40.7	Very low	40.4	Very low	231 Å²	231	156.4 Å²	156.4	87%	0.872	79%	0.79	S	S	*	*			trans	-68.3	104	177.8	-170.8	-179.4	-162.8	177	5.2	110.5	N20 K24	N20-R22 PolarHBondContact O-N 2.9Å; R22-K24 PolarHBondContact O-N 3.31Å
23	T	38.6	Very low	40.6	Very low	128 Å²	128	153.3 Å²	153.3	79%	0.785	78%	0.783	S	S	*	*			trans	-68.9	113.6	171.1	-34.4	0	0	0	0	109	K21 T25	K21-T23 PolarHBondContact O-N 3.03Å; T23-T25 PolarHBondContact O-N 2.92Å
24	K	40.1	Very low	40.5	Very low	194 Å²	194	158.9 Å²	158.9	84%	0.843	79%	0.791	S	S	*	*			trans	-80.1	109.8	171.8	-67.5	-179.6	179.8	179.8	0	107.8	R22	R22-K24 PolarHBondContact O-N 3.31Å
25	T	36.6	Very low	40.8	Very low	124 Å²	124	154.8 Å²	154.8	76%	0.761	78%	0.775	S	S	*	*			trans	-73.8	141.7	170.8	38.2	0	0	0	0	110.3	T23	T23-T25 PolarHBondContact O-N 2.92Å
26	P	38.4	Very low	41.1	Very low	117 Å²	117	150.1 Å²	150.1	76%	0.76	76%	0.76	S	S	*	*			trans	-74.2	137.5	-173	27.7	-32.5	0	0	0	112.5	T28	P26-T28 PolarHBondContact O-N 3.37Å; P26-T28 VanDerWaalsContact O-N 3.1Å
27	T	36.6	Very low	41.8	Very low	145 Å²	145	147.7 Å²	147.7	89%	0.89	75%	0.752	S	S	*	*			trans	-68	95	176.6	-39.1	0	0	0	0	110
28	T	38.4	Very low	41.9	Very low	130 Å²	130	149.5 Å²	149.5	80%	0.798	75%	0.753	S	S	*	*			trans	-70.1	133.2	171.6	-71.2	0	0	0	0	110.3	P26	P26-T28 PolarHBondContact O-N 3.37Å; P26-T28 VanDerWaalsContact O-N 3.1Å
29	S	41.8	Very low	42.1	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	75%	0.745	S	S	*	*			trans	-62.5	140.4	-174.2	40	0	0	0	0	113.6	T31	S29-T31 PolarHBondContact O-N 3.44Å
30	R	37.4	Very low	42.6	Very low	230 Å²	230	144.8 Å²	144.8	87%	0.868	73%	0.731	S	S	*	*			trans	-59.9	96.9	-179.6	-161	175.7	96.1	179.1	10.6	110.4
31	T	36.6	Very low	43.3	Very low	116 Å²	116	142.5 Å²	142.5	71%	0.712	72%	0.716	S	S	*	*			trans	-83	119.3	160.7	-54.3	0	0	0	0	106.5	S29 V33	S29-T31 PolarHBondContact O-N 3.44Å; T31-V33 HydrophobicContact CG2-CG2 4.14Å; T31-V33 PolarHBondContact O-N 3.48Å
32	E	39.4	Very low	44.1	Very low	172 Å²	172	137.7 Å²	137.7	80%	0.804	70%	0.702	S	S	*	*			trans	-68.2	75.2	179.5	-165.1	169	-154.5	0	0	109.2	R34	E32-R34 PolarHBondContact O-N 3.01Å
33	V	42.9	Very low	44.9	Very low	115 Å²	115	131.5 Å²	131.5	70%	0.697	69%	0.686	S	S	*	*			trans	-81.8	102.8	174.4	-179.4	0	0	0	0	106.6	T31 E35	T31-V33 HydrophobicContact CG2-CG2 4.14Å; T31-V33 PolarHBondContact O-N 3.48Å; V33-E35 PolarHBondContact O-N 3.5Å
34	R	43.3	Very low	45.9	Very low	237 Å²	237	131.8 Å²	131.8	89%	0.894	68%	0.676	S	S	*	*			trans	-35.4	99.3	169.8	-155.4	177.3	-177.2	-166.3	0.6	110.4	E32 P36	E32-R34 PolarHBondContact O-N 3.01Å; R34-P36 WeakPolarHBondContact O-CD 3.34Å
35	E	44.3	Very low	47	Very low	118 Å²	118	127.5 Å²	127.5	55%	0.551	66%	0.663	S	S	*	*			trans	-66	119.2	-173.5	-160.4	177.3	-179.2	0	0	109.2	V33 L37	V33-E35 PolarHBondContact O-N 3.5Å; E35-L37 PolarHBondContact O-N 3.07Å
36	P	47.7	Very low	48.3	Very low	74 Å²	74	124.4 Å²	124.4	48%	0.481	65%	0.65	S	S	.	*			trans	-67.8	130.1	179.3	-15.6	28.9	0	0	0	109.5	R34 H38 Q39	R34-P36 WeakPolarHBondContact O-CD 3.34Å; P36-H38 PolarHBondContact O-N 3.03Å; P36-Q39 PolarHBondContact O-N 2.77Å
37	L	54.2	Low	49.7	Very low	132 Å²	132	125.8 Å²	125.8	69%	0.691	65%	0.646	S	S	*	*	H	α-helix	trans	-45.3	-27.3	-177.5	-151.2	118.2	0	0	0	114.4	E35 Q39 L40 E41	E35-L37 PolarHBondContact O-N 3.07Å; L37-Q39 PolarHBondContact O-N 3.29Å; L37-L40 PolarHBondContact O-N 3.31Å; L37-E41 PolarHBondContact O-N 2.97Å
38	H	48.7	Very low	51.6	Low	143 Å²	143	122.9 Å²	122.9	66%	0.662	63%	0.625	S	S	*	*	H	α-helix	trans	-67.8	-26.3	177.3	-67.4	-64.4	0	0	0	115.2	P36 T42	P36-H38 PolarHBondContact O-N 3.03Å; H38-T42 PolarHBondContact O-N 3.15Å; H38-T42 PolarHBondContact O-OG1 3.44Å
39	Q	52.8	Low	53.1	Low	110 Å²	110	119.5 Å²	119.5	51%	0.514	61%	0.61	S	S	.	*	H	α-helix	trans	-75.4	-34.7	176	-77.5	-174.1	6	0	0	112.1	P36 L37 E41 T42 L43	P36-Q39 PolarHBondContact O-N 2.77Å; L37-Q39 PolarHBondContact O-N 3.29Å; Q39-E41 PolarHBondContact O-N 2.83Å; Q39-T42 VanDerWaalsContact CA-OG1 3.3Å; Q39-T42 WeakPolarHBondContact CA-OG1 3.29Å; Q39-T42 PolarHBondContact O-N 3.12Å; Q39-T42 PolarHBondContact O-OG1 3.28Å; Q39-T42 VanDerWaalsContact O-OG1 3.07Å; Q39-L43 PolarHBondContact O-N 3.16Å
40	L	53.5	Low	54.6	Low	83 Å²	83	124 Å²	124	44%	0.435	61%	0.611	S	S	.	*	H	α-helix	trans	-67.8	-37.1	177.7	-160.5	74.9	0	0	0	111.7	L37 K44	L37-L40 PolarHBondContact O-N 3.31Å; L40-K44 WeakPolarHBondContact O-CB 3.33Å; L40-K44 WeakPolarHBondContact O-CG 3.3Å; L40-K44 PolarHBondContact O-N 3.03Å
41	E	56.7	Low	56.4	Low	103 Å²	103	120.5 Å²	120.5	48%	0.481	60%	0.599	S	S	.	*	H	α-helix	trans	-66.2	-39.4	173.2	-78.1	-178.8	161.4	0	0	112.4	L37 Q39 K44 N45	L37-E41 PolarHBondContact O-N 2.97Å; Q39-E41 PolarHBondContact O-N 2.83Å; E41-K44 PolarHBondContact O-N 2.82Å; E41-N45 VanDerWaalsContact O-CB 3.29Å; E41-N45 WeakPolarHBondContact O-CB 3.39Å; E41-N45 PolarHBondContact O-N 2.85Å; E41-N45 PolarHBondContact O-ND2 3.37Å
42	T	57.2	Low	57.9	Low	89 Å²	89	118 Å²	118	55%	0.546	58%	0.581	S	S	.	*	H	α-helix	trans	-66.9	-39	177.6	18.1	0	0	0	0	112	H38 Q39 N45 A46	H38-T42 PolarHBondContact O-N 3.15Å; H38-T42 PolarHBondContact O-OG1 3.44Å; Q39-T42 VanDerWaalsContact CA-OG1 3.3Å; Q39-T42 WeakPolarHBondContact CA-OG1 3.29Å; Q39-T42 PolarHBondContact O-N 3.12Å; Q39-T42 PolarHBondContact O-OG1 3.28Å; Q39-T42 VanDerWaalsContact O-OG1 3.07Å; T42-N45 PolarHBondContact O-N 3.38Å; T42-A46 WeakPolarHBondContact O-CB 3.49Å; T42-A46 PolarHBondContact O-N 3.1Å
43	L	58	Low	59.6	Low	102 Å²	102	117.6 Å²	117.6	53%	0.534	57%	0.572	S	S	.	*	H	α-helix	trans	-66	-46.1	174.9	-72.4	172.2	0	0	0	112.2	Q39 N45 A46 E47	Q39-L43 PolarHBondContact O-N 3.16Å; L43-N45 VanDerWaalsContact C-N 3.29Å; L43-N45 PolarHBondContact O-N 2.91Å; L43-A46 PolarHBondContact O-N 3.19Å; L43-A46 VanDerWaalsContact O-N 3.16Å; L43-E47 PolarHBondContact O-N 3.34Å
44	K	59	Low	60.9	Low	133 Å²	133	116.7 Å²	116.7	58%	0.578	56%	0.563	S	S	*	*	H	α-helix	trans	-60.2	-39.4	175.3	-76	-180	179.3	-178.6	0	112.1	L40 E41 N48	L40-K44 WeakPolarHBondContact O-CB 3.33Å; L40-K44 WeakPolarHBondContact O-CG 3.3Å; L40-K44 PolarHBondContact O-N 3.03Å; E41-K44 PolarHBondContact O-N 2.82Å; K44-N48 WeakPolarHBondContact O-CB 3.48Å; K44-N48 PolarHBondContact O-N 3.2Å
45	N	63	Low	61.7	Low	105 Å²	105	107.6 Å²	107.6	56%	0.561	53%	0.534	S	S	*	.	H	α-helix	trans	-67.4	-37.2	176.5	-75.6	-19.1	0	0	0	112.3	E41 T42 L43 N48 A49	E41-N45 VanDerWaalsContact O-CB 3.29Å; E41-N45 WeakPolarHBondContact O-CB 3.39Å; E41-N45 PolarHBondContact O-N 2.85Å; E41-N45 PolarHBondContact O-ND2 3.37Å; T42-N45 PolarHBondContact O-N 3.38Å; L43-N45 VanDerWaalsContact C-N 3.29Å; L43-N45 PolarHBondContact O-N 2.91Å; N45-N48 PolarHBondContact O-N 2.92Å; N45-A49 VanDerWaalsContact O-CB 3.26Å; N45-A49 WeakPolarHBondContact O-CB 3.36Å; N45-A49 PolarHBondContact O-N 3.43Å
46	A	65.3	Low	62.3	Low	59 Å²	59	110 Å²	110	49%	0.488	54%	0.538	S	S	.	.	H	α-helix	trans	-66.9	-42.3	176.7	0	0	0	0	0	112.3	T42 L43 A49 R50	T42-A46 WeakPolarHBondContact O-CB 3.49Å; T42-A46 PolarHBondContact O-N 3.1Å; L43-A46 PolarHBondContact O-N 3.19Å; L43-A46 VanDerWaalsContact O-N 3.16Å; A46-A49 PolarHBondContact O-N 2.96Å; A46-R50 PolarHBondContact O-N 3.24Å
47	E	68	Low	62.7	Low	145 Å²	145	110.9 Å²	110.9	68%	0.678	54%	0.536	S	S	*	.	H	α-helix	trans	-64.9	-42.6	175.3	-69.6	-175.4	161	0	0	111.8	L43 R50 Y51	L43-E47 PolarHBondContact O-N 3.34Å; E47-R50 WeakPolarHBondContact O-CB 3.31Å; E47-R50 PolarHBondContact O-N 2.96Å; E47-Y51 PolarHBondContact O-N 3.36Å
48	N	75	Confident	62.7	Low	85 Å²	85	108.1 Å²	108.1	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-40.9	175.3	-168.5	15.7	0	0	0	111.7	K44 N45 R50 Y51 I52	K44-N48 WeakPolarHBondContact O-CB 3.48Å; K44-N48 PolarHBondContact O-N 3.2Å; N45-N48 PolarHBondContact O-N 2.92Å; N48-R50 VanDerWaalsContact C-N 3.32Å; N48-R50 PolarHBondContact O-N 3.01Å; N48-Y51 PolarHBondContact O-N 3.26Å; N48-I52 WeakPolarHBondContact O-CB 3.48Å; N48-I52 VanDerWaalsContact O-CG1 3.31Å; N48-I52 WeakPolarHBondContact O-CG1 3.47Å; N48-I52 PolarHBondContact O-N 3.39Å
49	A	71.5	Confident	62.9	Low	58 Å²	58	108.1 Å²	108.1	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-61.7	-40.2	174.5	0	0	0	0	0	111.8	N45 A46 W53	N45-A49 VanDerWaalsContact O-CB 3.26Å; N45-A49 WeakPolarHBondContact O-CB 3.36Å; N45-A49 PolarHBondContact O-N 3.43Å; A46-A49 PolarHBondContact O-N 2.96Å; A49-W53 WeakPolarHBondContact O-CB 3.26Å; A49-W53 PolarHBondContact O-N 3.04Å
50	R	72.1	Confident	62.9	Low	194 Å²	194	113 Å²	113	73%	0.732	54%	0.538	S	S	*	.	H	α-helix	trans	-64	-42.7	175.5	-159.9	-175.7	91.4	118	1	111.7	A46 E47 N48 W53 L54	A46-R50 PolarHBondContact O-N 3.24Å; E47-R50 WeakPolarHBondContact O-CB 3.31Å; E47-R50 PolarHBondContact O-N 2.96Å; N48-R50 VanDerWaalsContact C-N 3.32Å; N48-R50 PolarHBondContact O-N 3.01Å; R50-W53 PolarHBondContact O-N 3.49Å; R50-L54 WeakPolarHBondContact O-CB 3.49Å; R50-L54 PolarHBondContact O-N 3.06Å
51	Y	74.3	Confident	62.7	Low	157 Å²	157	113 Å²	113	62%	0.616	55%	0.545	S	S	*	.	H	α-helix	trans	-62.3	-50.1	176.5	-177.1	-98.6	0	0	0	111.4	E47 N48 W53 L54 T55	E47-Y51 PolarHBondContact O-N 3.36Å; N48-Y51 PolarHBondContact O-N 3.26Å; Y51-W53 VanDerWaalsContact C-N 3.33Å; Y51-W53 PolarHBondContact O-N 3.22Å; Y51-L54 PolarHBondContact O-N 3.11Å; Y51-T55 PolarHBondContact O-N 2.88Å; Y51-T55 PolarHBondContact O-OG1 3.07Å
52	I	69.7	Low	62.1	Low	64 Å²	64	112.1 Å²	112.1	33%	0.328	55%	0.547	S	S	.	.	H	α-helix	trans	-60.6	-41	178.3	-69	170.3	0	0	0	111.7	N48 T55 R56	N48-I52 WeakPolarHBondContact O-CB 3.48Å; N48-I52 VanDerWaalsContact O-CG1 3.31Å; N48-I52 WeakPolarHBondContact O-CG1 3.47Å; N48-I52 PolarHBondContact O-N 3.39Å; I52-T55 PolarHBondContact O-N 2.94Å; I52-R56 VanDerWaalsContact CG2-NE 3.31Å; I52-R56 WeakPolarHBondContact O-CG 3.35Å; I52-R56 PolarHBondContact O-N 3.48Å
53	W	74	Confident	61.6	Low	163 Å²	163	113.3 Å²	113.3	62%	0.617	56%	0.557	S	S	*	*	H	α-helix	trans	-63.2	-44.4	177.3	-175.6	86.5	0	0	0	111.3	A49 R50 Y51 R56 Q57	A49-W53 WeakPolarHBondContact O-CB 3.26Å; A49-W53 PolarHBondContact O-N 3.04Å; R50-W53 PolarHBondContact O-N 3.49Å; Y51-W53 VanDerWaalsContact C-N 3.33Å; Y51-W53 PolarHBondContact O-N 3.22Å; W53-R56 PolarHBondContact O-N 3.39Å; W53-Q57 HydrophobicContact CD2-CG 4.45Å; W53-Q57 HydrophobicContact CE3-CG 4.49Å; W53-Q57 HydrophobicContact CH2-CG 4.39Å; W53-Q57 HydrophobicContact CZ2-CG 4.34Å; W53-Q57 HydrophobicContact CZ3-CG 4.46Å; W53-Q57 WeakPolarHBondContact O-CG 3.47Å; W53-Q57 PolarHBondContact O-N 3.12Å
54	L	69.8	Low	61	Low	96 Å²	96	114.2 Å²	114.2	50%	0.503	57%	0.566	S	S	.	*	H	α-helix	trans	-63.4	-46.3	177.6	-168.4	68.1	0	0	0	111.5	R50 Y51 R56 Q57 T58	R50-L54 WeakPolarHBondContact O-CB 3.49Å; R50-L54 PolarHBondContact O-N 3.06Å; Y51-L54 PolarHBondContact O-N 3.11Å; L54-R56 VanDerWaalsContact C-N 3.32Å; L54-R56 PolarHBondContact O-N 2.94Å; L54-Q57 WeakPolarHBondContact O-CB 3.36Å; L54-Q57 PolarHBondContact O-N 3.05Å; L54-Q57 VanDerWaalsContact O-N 3.12Å; L54-T58 PolarHBondContact O-N 3.47Å; L54-T58 PolarHBondContact O-OG1 3.12Å; L54-T58 VanDerWaalsContact O-OG1 3.12Å
55	T	61.6	Low	60.2	Low	47 Å²	47	116.2 Å²	116.2	29%	0.288	58%	0.582	S	S	.	*	H	α-helix	trans	-61.7	-37.8	178.5	-51.6	0	0	0	0	112.3	Y51 I52 Q57 T58 Q59	Y51-T55 PolarHBondContact O-N 2.88Å; Y51-T55 PolarHBondContact O-OG1 3.07Å; I52-T55 PolarHBondContact O-N 2.94Å; T55-Q57 VanDerWaalsContact C-N 3.33Å; T55-Q57 PolarHBondContact O-N 3.14Å; T55-T58 PolarHBondContact O-N 3.21Å; T55-Q59 HydrophobicContact CG2-CG 4.49Å; T55-Q59 WeakPolarHBondContact O-CG 3.5Å; T55-Q59 PolarHBondContact O-N 3.37Å
56	R	55.8	Low	59.1	Low	168 Å²	168	116 Å²	116	63%	0.634	59%	0.589	S	S	*	*	H	α-helix	trans	-65.7	-33.7	175.4	-74.3	-178.2	-148.6	-105.6	3.5	112.8	I52 W53 L54 R60	I52-R56 VanDerWaalsContact CG2-NE 3.31Å; I52-R56 WeakPolarHBondContact O-CG 3.35Å; I52-R56 PolarHBondContact O-N 3.48Å; W53-R56 PolarHBondContact O-N 3.39Å; L54-R56 VanDerWaalsContact C-N 3.32Å; L54-R56 PolarHBondContact O-N 2.94Å; R56-R60 PolarHBondContact O-N 3.31Å
57	Q	56	Low	57.9	Low	92 Å²	92	121.2 Å²	121.2	43%	0.43	60%	0.603	S	S	.	*	H	α-helix	trans	-68.8	-43	173.9	-65.1	-59.5	-36.2	0	0	111	W53 L54 T55 R60 S61	W53-Q57 HydrophobicContact CD2-CG 4.45Å; W53-Q57 HydrophobicContact CE3-CG 4.49Å; W53-Q57 HydrophobicContact CH2-CG 4.39Å; W53-Q57 HydrophobicContact CZ2-CG 4.34Å; W53-Q57 HydrophobicContact CZ3-CG 4.46Å; W53-Q57 WeakPolarHBondContact O-CG 3.47Å; W53-Q57 PolarHBondContact O-N 3.12Å; L54-Q57 WeakPolarHBondContact O-CB 3.36Å; L54-Q57 PolarHBondContact O-N 3.05Å; L54-Q57 VanDerWaalsContact O-N 3.12Å; T55-Q57 VanDerWaalsContact C-N 3.33Å; T55-Q57 PolarHBondContact O-N 3.14Å; Q57-R60 PolarHBondContact O-N 3.02Å; Q57-S61 PolarHBondContact O-N 3.15Å
58	T	54.6	Low	56.4	Low	75 Å²	75	121.5 Å²	121.5	46%	0.46	61%	0.605	S	S	.	*	H	α-helix	trans	-66.8	-39.5	179.3	-46.5	0	0	0	0	112.6	L54 T55 R60 S61 T62	L54-T58 PolarHBondContact O-N 3.47Å; L54-T58 PolarHBondContact O-OG1 3.12Å; L54-T58 VanDerWaalsContact O-OG1 3.12Å; T55-T58 PolarHBondContact O-N 3.21Å; T58-R60 PolarHBondContact O-N 3.1Å; T58-S61 PolarHBondContact O-N 3.34Å; T58-S61 VanDerWaalsContact O-N 3.1Å; T58-S61 PolarHBondContact O-OG 3.3Å; T58-T62 PolarHBondContact O-N 3.27Å
59	Q	53.3	Low	54.7	Low	142 Å²	142	128 Å²	128	66%	0.664	62%	0.623	S	S	*	*	H	α-helix	trans	-66.9	-25.9	176.5	-73.7	-173.9	2.5	0	0	113.2	T55 S61	T55-Q59 HydrophobicContact CG2-CG 4.49Å; T55-Q59 WeakPolarHBondContact O-CG 3.5Å; T55-Q59 PolarHBondContact O-N 3.37Å; Q59-S61 VanDerWaalsContact C-N 3.32Å
60	R	52.7	Low	53.4	Low	212 Å²	212	133.4 Å²	133.4	80%	0.8	64%	0.638	S	S	*	*	H	α-helix	trans	-74.5	-21.8	173.1	-81.3	-174.9	164.9	-158.7	-4.3	113.1	R56 Q57 T58	R56-R60 PolarHBondContact O-N 3.31Å; Q57-R60 PolarHBondContact O-N 3.02Å; T58-R60 PolarHBondContact O-N 3.1Å
61	S	49.2	Very low	51.8	Low	83 Å²	83	133.2 Å²	133.2	58%	0.58	64%	0.639	S	S	*	*	H	α-helix	trans	-103.6	-1.5	-175.4	64.9	0	0	0	0	115	Q57 T58 Q59 P63	Q57-S61 PolarHBondContact O-N 3.15Å; T58-S61 PolarHBondContact O-N 3.34Å; T58-S61 VanDerWaalsContact O-N 3.1Å; T58-S61 PolarHBondContact O-OG 3.3Å; Q59-S61 VanDerWaalsContact C-N 3.32Å; S61-P63 WeakPolarHBondContact O-CD 3.46Å
62	T	44.7	Very low	50.4	Low	85 Å²	85	129.6 Å²	129.6	52%	0.521	65%	0.65	S	S	.	*			trans	-91.4	95.3	166.7	56.1	0	0	0	0	108.9	T58 V64	T58-T62 PolarHBondContact O-N 3.27Å; T62-V64 VanDerWaalsContact C-N 3.32Å; T62-V64 PolarHBondContact O-N 3.02Å
63	P	46.3	Very low	49.2	Very low	114 Å²	114	137.8 Å²	137.8	74%	0.74	68%	0.676	S	S	*	*			trans	-60.6	106.6	161.5	27.3	-31.7	0	0	0	105.8	S61 L65	S61-P63 WeakPolarHBondContact O-CD 3.46Å; P63-L65 PolarHBondContact O-N 3.26Å
64	V	44.2	Very low	48	Very low	122 Å²	122	136.9 Å²	136.9	74%	0.739	68%	0.682	S	S	*	*			trans	-49.3	113.7	165	171.7	0	0	0	0	104.9	T62 S66	T62-V64 VanDerWaalsContact C-N 3.32Å; T62-V64 PolarHBondContact O-N 3.02Å; V64-S66 PolarHBondContact O-N 2.71Å
65	L	42.5	Very low	47.3	Very low	175 Å²	175	139 Å²	139	92%	0.916	69%	0.694	S	S	*	*			trans	-64.6	59.7	167.4	-90.3	149.8	0	0	0	108	P63 Q67	P63-L65 PolarHBondContact O-N 3.26Å; L65-Q67 VanDerWaalsContact C-N 3.35Å; L65-Q67 PolarHBondContact O-N 3.2Å; L65-Q67 VanDerWaalsContact O-N 3.14Å
66	S	41.7	Very low	47.1	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	72%	0.721	S	S	*	*			trans	-73.7	98.8	164.6	171.2	0	0	0	0	104.3	V64	V64-S66 PolarHBondContact O-N 2.71Å
67	Q	38.7	Very low	46.9	Very low	169 Å²	169	143.5 Å²	143.5	79%	0.79	73%	0.726	S	S	*	*			trans	-43.1	147.7	164.2	-75.7	174.3	-2.8	0	0	110.6	L65	L65-Q67 VanDerWaalsContact C-N 3.35Å; L65-Q67 PolarHBondContact O-N 3.2Å; L65-Q67 VanDerWaalsContact O-N 3.14Å
68	E	36.4	Very low	46.7	Very low	151 Å²	151	143.8 Å²	143.8	71%	0.706	74%	0.739	S	S	*	*			trans	76.5	80.4	147.7	-156.3	168.6	-154.2	0	0	117.1
69	R	40.4	Very low	46.8	Very low	221 Å²	221	144.8 Å²	144.8	83%	0.834	75%	0.745	S	S	*	*				-133.7	98.3	127.3	-70.8	-164.4	-171	175.9	4.3	109.2	Y71	R69-Y71 HydrophobicContact CB-CD2 3.97Å; R69-Y71 HydrophobicContact CB-CE2 4.18Å; R69-Y71 PolarHBondContact O-N 3.09Å
70	Q	43.6	Very low	46.5	Very low	171 Å²	171	146 Å²	146	80%	0.799	75%	0.75	S	S	*	*			trans	-56.6	87.2	162.8	-71.2	167.9	-42.7	0	0	109.5
71	Y	39.3	Very low	46.3	Very low	190 Å²	190	147.8 Å²	147.8	75%	0.745	76%	0.757	S	S	*	*			trans	-126.6	107.1	156.4	-69.6	-75.7	0	0	0	106.2	R69 R73	R69-Y71 HydrophobicContact CB-CD2 3.97Å; R69-Y71 HydrophobicContact CB-CE2 4.18Å; R69-Y71 PolarHBondContact O-N 3.09Å; Y71-R73 PolarHBondContact O-N 2.98Å
72	G	43.4	Very low	46.4	Very low	82 Å²	82	147.5 Å²	147.5	85%	0.845	77%	0.767	S	S	*	*			trans	-49.5	99.8	-179.4	0	0	0	0	0	110.3	I74	G72-I74 PolarHBondContact O-N 3.25Å
73	R	44.7	Very low	46.5	Very low	235 Å²	235	150.6 Å²	150.6	89%	0.887	78%	0.776	S	S	*	*			trans	-81	113	171	-88.3	-176.2	166.2	172.7	-3.5	107.1	Y71 N75	Y71-R73 PolarHBondContact O-N 2.98Å; R73-N75 PolarHBondContact O-N 2.77Å
74	I	50	Low	46.7	Very low	144 Å²	144	150.4 Å²	150.4	74%	0.738	78%	0.777	S	S	*	*			trans	-50.3	121.9	175.3	-57.1	160	0	0	0	108.1	G72 L76	G72-I74 PolarHBondContact O-N 3.25Å; I74-L76 PolarHBondContact O-N 3.09Å
75	N	54	Low	47.2	Very low	140 Å²	140	149.9 Å²	149.9	75%	0.749	78%	0.776	S	S	*	*			trans	-64.4	99.8	176.8	-74.9	-24.2	0	0	0	109	R73 I77	R73-N75 PolarHBondContact O-N 2.77Å; N75-I77 PolarHBondContact O-N 2.93Å
76	L	58	Low	47.8	Very low	165 Å²	165	146.9 Å²	146.9	86%	0.864	77%	0.769	S	S	*	*			trans	-81.8	7.8	176.6	-68.8	175.7	0	0	0	113.3	I74	I74-L76 PolarHBondContact O-N 3.09Å
77	I	50.9	Low	48.2	Very low	146 Å²	146	153.4 Å²	153.4	75%	0.749	78%	0.779	S	S	*	*	S	Bend	trans	-117	108.7	176.2	-55.4	173	0	0	0	106.4	N75 T79	N75-I77 PolarHBondContact O-N 2.93Å; I77-T79 PolarHBondContact O-N 2.7Å; I77-T79 VanDerWaalsContact O-N 3.12Å
78	S	52.3	Low	48.4	Very low	98 Å²	98	156.8 Å²	156.8	69%	0.685	78%	0.784	S	S	*	*			trans	-48.1	118.3	167.1	168.9	0	0	0	0	108.5	H80	S78-H80 PolarHBondContact O-N 3.14Å
79	T	55.7	Low	48.5	Very low	96 Å²	96	152.6 Å²	152.6	59%	0.589	78%	0.782	S	S	*	*	S	Bend	trans	-65	11.5	179.1	46	0	0	0	0	113.3	I77 R81	I77-T79 PolarHBondContact O-N 2.7Å; I77-T79 VanDerWaalsContact O-N 3.12Å; T79-R81 PolarHBondContact O-N 2.88Å
80	H	48.7	Very low	48.4	Very low	166 Å²	166	150.1 Å²	150.1	77%	0.769	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	66.1	-178.1	-122.3	-25.2	0	0	0	112.2	S78	S78-H80 PolarHBondContact O-N 3.14Å
81	R	48.5	Very low	48.4	Very low	250 Å²	250	147.4 Å²	147.4	94%	0.943	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-165.9	94.3	146.3	-104.9	170.7	-164.3	-140.2	4.6	109.4	T79	T79-R81 PolarHBondContact O-N 2.88Å
82	G	51.2	Low	48.5	Very low	77 Å²	77	146 Å²	146	79%	0.794	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.1	6	158.8	0	0	0	0	0	117.9	S84	G82-S84 PolarHBondContact O-N 2.94Å
83	E	46.7	Very low	48.7	Very low	151 Å²	151	148.5 Å²	148.5	71%	0.706	78%	0.779	S	S	*	*			trans	-67.7	107.8	165.9	-88.4	-173	156.4	0	0	109
84	S	50.1	Low	48.7	Very low	110 Å²	110	142 Å²	142	77%	0.769	77%	0.769	S	S	*	*			trans	-59.6	125.2	171	-67.9	0	0	0	0	107.6	G82 S86	G82-S84 PolarHBondContact O-N 2.94Å; S84-S86 PolarHBondContact O-N 3.38Å; S84-S86 VanDerWaalsContact O-N 3.1Å
85	P	54.8	Low	48.4	Very low	111 Å²	111	141.6 Å²	141.6	72%	0.721	77%	0.774	S	S	*	*			trans	-53.5	124.8	-174.7	17.5	-29.1	0	0	0	109.4	R87	P85-R87 VanDerWaalsContact C-N 3.33Å; P85-R87 PolarHBondContact O-N 3.4Å
86	S	55.2	Low	47.9	Very low	111 Å²	111	138.7 Å²	138.7	78%	0.776	77%	0.769	S	S	*	*			trans	-53.4	95.1	175.8	167.1	0	0	0	0	109	S84 R88	S84-S86 PolarHBondContact O-N 3.38Å; S84-S86 VanDerWaalsContact O-N 3.1Å; S86-R88 PolarHBondContact O-N 2.99Å
87	R	49.6	Very low	47.2	Very low	238 Å²	238	142 Å²	142	90%	0.898	77%	0.77	S	S	*	*			trans	-70.9	85.7	174.3	-73.8	-169.3	-174.5	-135.1	2.9	108.4	P85 G89	P85-R87 VanDerWaalsContact C-N 3.33Å; P85-R87 PolarHBondContact O-N 3.4Å; R87-G89 PolarHBondContact O-N 3.27Å
88	R	43.4	Very low	47.2	Very low	240 Å²	240	138.1 Å²	138.1	91%	0.906	76%	0.76	S	S	*	*			trans	-64.8	108.5	158.9	-107.6	-174.3	-175	-117.8	2.5	107.6	S86	S86-R88 PolarHBondContact O-N 2.99Å
89	G	38.8	Very low	46.8	Very low	63 Å²	63	141.8 Å²	141.8	65%	0.649	77%	0.766	S	S	*	*	S	Bend	trans	85.6	148.6	156.3	0	0	0	0	0	116	R87	R87-G89 PolarHBondContact O-N 3.27Å
90	Q	38.2	Very low	46.5	Very low	168 Å²	168	145.1 Å²	145.1	79%	0.785	78%	0.775	S	S	*	*			trans	91.9	86.9	176.5	-50.3	-71.3	0.3	0	0	113.9	E92	Q90-E92 VanDerWaalsContact C-N 3.26Å; Q90-E92 PolarHBondContact O-N 2.73Å
91	S	42.8	Very low	46.3	Very low	115 Å²	115	149.4 Å²	149.4	80%	0.804	78%	0.784	S	S	*	*			trans	-62.1	83.5	159.9	49.1	0	0	0	0	109.6
92	E	42.3	Very low	46.4	Very low	160 Å²	160	141.3 Å²	141.3	75%	0.748	78%	0.778	S	S	*	*			trans	-95	103.7	162.4	-71	-177.5	-171	0	0	107.1	Q90 S94	Q90-E92 VanDerWaalsContact C-N 3.26Å; Q90-E92 PolarHBondContact O-N 2.73Å; E92-S94 PolarHBondContact O-N 2.84Å
93	T	46.4	Very low	46.4	Very low	135 Å²	135	139.9 Å²	139.9	83%	0.828	76%	0.764	S	S	*	*			trans	-61.2	70.5	166.4	49.1	0	0	0	0	108.9	T95	T93-T95 PolarHBondContact O-N 2.73Å
94	S	44	Very low	47.1	Very low	98 Å²	98	138 Å²	138	69%	0.685	76%	0.758	S	S	*	*			trans	-79.6	106.5	169.8	-177.4	0	0	0	0	106.4	E92 A96	E92-S94 PolarHBondContact O-N 2.84Å; S94-A96 PolarHBondContact O-N 3.42Å
95	T	44.5	Very low	47.5	Very low	136 Å²	136	138.7 Å²	138.7	83%	0.834	75%	0.748	S	S	*	*			trans	-63.8	64.7	171	51.1	0	0	0	0	109.8	T93 R97	T93-T95 PolarHBondContact O-N 2.73Å; T95-R97 VanDerWaalsContact C-N 3.32Å; T95-R97 PolarHBondContact O-N 3.14Å; T95-R97 VanDerWaalsContact O-N 3.09Å
96	A	44.8	Very low	47.8	Very low	78 Å²	78	139.2 Å²	139.2	65%	0.645	74%	0.744	S	S	*	*			trans	-73.1	98.2	160.5	0	0	0	0	0	105.3	S94 A98	S94-A96 PolarHBondContact O-N 3.42Å; A96-A98 PolarHBondContact O-N 3.2Å
97	R	41.7	Very low	48	Very low	234 Å²	234	137.3 Å²	137.3	88%	0.883	73%	0.728	S	S	*	*			trans	-54.2	86.8	161	-82.6	-175	170	109.9	-3.5	107.1	T95 E99	T95-R97 VanDerWaalsContact C-N 3.32Å; T95-R97 PolarHBondContact O-N 3.14Å; T95-R97 VanDerWaalsContact O-N 3.09Å; R97-E99 PolarHBondContact O-N 2.84Å
98	A	51.1	Low	48.6	Very low	65 Å²	65	130.6 Å²	130.6	54%	0.537	71%	0.707	S	S	.	*			trans	-77.5	78.9	172.9	0	0	0	0	0	106.1	A96 H100	A96-A98 PolarHBondContact O-N 3.2Å; A98-H100 PolarHBondContact O-N 2.94Å
99	E	44.8	Very low	49.4	Very low	176 Å²	176	126.6 Å²	126.6	82%	0.822	70%	0.7	S	S	*	*			trans	-64	66.9	160.8	-70.8	-169.5	162.3	0	0	108.5	R97 R101	R97-E99 PolarHBondContact O-N 2.84Å; E99-R101 PolarHBondContact O-N 2.97Å; E99-R101 VanDerWaalsContact O-N 3.09Å
100	H	49.2	Very low	50.4	Low	166 Å²	166	126.8 Å²	126.8	77%	0.769	69%	0.686	S	S	*	*			trans	-85.4	64.2	168.7	-66.2	-42.6	0	0	0	108.3	A98 G102	A98-H100 PolarHBondContact O-N 2.94Å; H100-G102 PolarHBondContact O-N 2.75Å
101	R	44.8	Very low	51.4	Low	255 Å²	255	125 Å²	125	96%	0.962	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	23.7	177.2	-124	-174.3	-169	-109.2	3.3	113.4	E99	E99-R101 PolarHBondContact O-N 2.97Å; E99-R101 VanDerWaalsContact O-N 3.09Å
102	G	50.1	Low	52.2	Low	80 Å²	80	121.7 Å²	121.7	83%	0.825	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.5	17	-172.7	0	0	0	0	0	116.9	H100	H100-G102 PolarHBondContact O-N 2.75Å
103	G	50.9	Low	53.1	Low	48 Å²	48	121.4 Å²	121.4	50%	0.495	69%	0.686	S	S	.	*			trans	-92.7	143.3	173.5	0	0	0	0	0	111.6	F105	G103-F105 PolarHBondContact O-N 3.37Å
104	L	61.1	Low	54	Low	111 Å²	111	122.4 Å²	122.4	58%	0.581	68%	0.679	S	S	*	*	S	Bend	trans	-57.2	-14.3	172.7	-156.4	81.9	0	0	0	112.9	W124	L104-W124 HydrophobicContact CD2-CD2 3.95Å; L104-W124 HydrophobicContact CD2-CE3 4.32Å; L104-W124 HydrophobicContact CD2-CG 4.1Å; L104-W124 HydrophobicContact CG-CD2 4.46Å; L104-W124 HydrophobicContact CG-CZ2 4.42Å; L104-W124 VanDerWaalsContact O-CH2 3.24Å; L104-W124 WeakPolarHBondContact O-CH2 3.43Å; L104-W124 WeakPolarHBondContact O-CZ2 3.24Å
105	F	59	Low	55.1	Low	125 Å²	125	121.6 Å²	121.6	55%	0.548	68%	0.678	S	S	.	*	S	Bend	trans	-102.9	104.1	-176.9	-52	-73.2	0	0	0	110.1	G103 V107 W124	G103-F105 PolarHBondContact O-N 3.37Å; F105-V107 PolarHBondContact O-N 3.26Å; F105-W124 HydrophobicContact CD1-CZ3 4.02Å; F105-W124 HydrophobicContact CE1-CE3 4.46Å; F105-W124 HydrophobicContact CE1-CZ3 4.14Å
106	N	61.6	Low	56.7	Low	121 Å²	121	118.9 Å²	118.9	65%	0.647	66%	0.662	S	S	*	*			trans	-69.7	110.5	168.1	-75.3	-29.9	0	0	0	109.1	H108	N106-H108 PolarHBondContact O-N 2.87Å
107	V	60.1	Low	58.3	Low	72 Å²	72	121.6 Å²	121.6	44%	0.436	66%	0.657	S	S	.	*			trans	-80.8	100.2	172	-172.9	0	0	0	0	107.9	F105 M109	F105-V107 PolarHBondContact O-N 3.26Å; V107-M109 HydrophobicContact CB-CE 4.34Å; V107-M109 HydrophobicContact CG1-CE 3.28Å; V107-M109 HydrophobicContact CG1-CG 4.49Å; V107-M109 PolarHBondContact O-N 2.79Å; V107-M109 VanDerWaalsContact O-N 3.11Å
108	H	60.6	Low	60.3	Low	97 Å²	97	117.5 Å²	117.5	45%	0.449	64%	0.642	S	S	.	*			trans	-73.2	103.7	171.8	-67	95.8	0	0	0	108.5	N106 N110	N106-H108 PolarHBondContact O-N 2.87Å; H108-N110 PolarHBondContact O-N 3.1Å; H108-N110 VanDerWaalsContact O-N 3.1Å; H108-N110 PolarHBondContact O-OD1 3.03Å
109	M	60.9	Low	61.7	Low	156 Å²	156	118.6 Å²	118.6	77%	0.768	64%	0.638	S	S	*	*			trans	-77.9	88.2	173.3	-71.8	-75.8	154.6	0	0	108.1	V107 S111	V107-M109 HydrophobicContact CB-CE 4.34Å; V107-M109 HydrophobicContact CG1-CE 3.28Å; V107-M109 HydrophobicContact CG1-CG 4.49Å; V107-M109 PolarHBondContact O-N 2.79Å; V107-M109 VanDerWaalsContact O-N 3.11Å; M109-S111 PolarHBondContact O-N 3.12Å; M109-S111 VanDerWaalsContact O-N 3.12Å
110	N	58.7	Low	63.4	Low	66 Å²	66	116 Å²	116	35%	0.353	63%	0.629	S	S	.	*			trans	-75.2	103.8	175.9	-52.8	-1.4	0	0	0	106.8	H108 G112 Y117	H108-N110 PolarHBondContact O-N 3.1Å; H108-N110 VanDerWaalsContact O-N 3.1Å; H108-N110 PolarHBondContact O-OD1 3.03Å; N110-G112 VanDerWaalsContact C-N 3.31Å; N110-G112 PolarHBondContact O-N 2.86Å; N110-Y117 WeakPolarHBondContact ND2-CE1 3.47Å
111	S	59.5	Low	64.7	Low	131 Å²	131	111.4 Å²	111.4	92%	0.916	61%	0.607	S	S	*	*	S	Bend	trans	-63.5	92	175	55.3	0	0	0	0	109.3	M109	M109-S111 PolarHBondContact O-N 3.12Å; M109-S111 VanDerWaalsContact O-N 3.12Å
112	G	59.4	Low	66	Low	45 Å²	45	103.8 Å²	103.8	46%	0.464	59%	0.591	S	S	.	*	S	Bend	trans	140	91.6	176.3	0	0	0	0	0	113.2	N110 K114	N110-G112 VanDerWaalsContact C-N 3.31Å; N110-G112 PolarHBondContact O-N 2.86Å; G112-K114 PolarHBondContact O-N 2.69Å
113	T	63.1	Low	67.2	Low	155 Å²	155	106.2 Å²	106.2	95%	0.951	58%	0.581	S	S	*	*	S	Bend	trans	62.3	-7.1	154.1	66.3	0	0	0	0	119.9
114	K	63.8	Low	68.4	Low	156 Å²	156	108.2 Å²	108.2	68%	0.678	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-103.2	128.7	179.9	-65.8	-172.9	-179.3	-175.6	0	110.1	G112	G112-K114 PolarHBondContact O-N 2.69Å
115	A	68.6	Low	68.9	Low	81 Å²	81	108.6 Å²	108.6	67%	0.669	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-52.7	144.8	172.8	0	0	0	0	0	110	Y117	A115-Y117 PolarHBondContact O-N 3.32Å
116	P	76.1	Confident	69.2	Low	78 Å²	78	106.6 Å²	106.6	51%	0.506	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-57.7	134.7	176.3	25.2	-33.6	0	0	0	109.3
117	Y	78.9	Confident	69.3	Low	135 Å²	135	110.2 Å²	110.2	53%	0.529	59%	0.59	S	S	.	*			trans	-120.2	145.4	171.1	64.7	-92.2	0	0	0	109.7	N110 A115 I119	N110-Y117 WeakPolarHBondContact ND2-CE1 3.47Å; A115-Y117 PolarHBondContact O-N 3.32Å; Y117-I119 HydrophobicContact CD2-CG1 4.26Å; Y117-I119 HydrophobicContact CE2-CD1 4.24Å; Y117-I119 HydrophobicContact CE2-CG1 4.04Å
118	Y	83.4	Confident	69.3	Low	148 Å²	148	111.4 Å²	111.4	58%	0.58	60%	0.598	S	S	*	*			trans	-100.6	131.2	-178.3	-58.3	-85.3	0	0	0	109.1
119	I	82	Confident	69.1	Low	89 Å²	89	114.1 Å²	114.1	46%	0.456	61%	0.612	S	S	.	*			trans	-94.2	113.3	170.8	-58.2	175.5	0	0	0	106.5	Y117 W124	Y117-I119 HydrophobicContact CD2-CG1 4.26Å; Y117-I119 HydrophobicContact CE2-CD1 4.24Å; Y117-I119 HydrophobicContact CE2-CG1 4.04Å; I119-W124 VanDerWaalsContact O-CZ3 3.32Å; I119-W124 WeakPolarHBondContact O-CZ3 2.95Å
120	I	79.6	Confident	68.9	Low	120 Å²	120	111.9 Å²	111.9	62%	0.615	61%	0.608	S	S	*	*			trans	-91	112	174.4	-57.1	173.7	0	0	0	107.3
121	H	76.1	Confident	68.9	Low	70 Å²	70	114.8 Å²	114.8	32%	0.324	62%	0.622	S	S	.	*			trans	-78.4	132.9	177.7	-83.2	-95.3	0	0	0	110.8	E123 W124	H121-E123 VanDerWaalsContact CB-CD 3.44Å; H121-E123 HydrophobicContact CB-CG 4.16Å; H121-E123 WeakPolarHBondContact CB-OE1 3.35Å; H121-E123 WeakPolarHBondContact CB-OE2 3.4Å; H121-E123 IonicContact CE1-OE1 3.92Å; H121-E123 IonicContact CG-OE1 3.38Å; H121-E123 IonicContact ND1-OE1 2.88Å; H121-E123 PolarHBondContact ND1-OE1 2.87Å; H121-E123 IonicContact ND1-OE2 3.75Å; H121-E123 PolarHBondContact O-N 3Å; H121-W124 HydrophobicContact CB-CD2 3.72Å; H121-W124 HydrophobicContact CB-CE3 4.18Å; H121-W124 HydrophobicContact CB-CG 3.96Å; H121-W124 HydrophobicContact CB-CZ2 4.17Å; H121-W124 AromaticContact CD2-CH2 3.85Å; H121-W124 AromaticContact CD2-CZ2 3.73Å; H121-W124 WeakPolarHBondContact O-CB 3.48Å; H121-W124 PolarHBondContact O-N 2.83Å
122	P	71.7	Confident	68.9	Low	96 Å²	96	118.3 Å²	118.3	62%	0.623	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-61.3	-31.2	-178.8	25.1	-33.5	0	0	0	112.3	W124 L125	P122-W124 PolarHBondContact O-N 3.07Å; P122-W124 VanDerWaalsContact O-N 3.15Å; P122-L125 CarbonylContact O-C 3.54Å; P122-L125 WeakPolarHBondContact O-CB 3.32Å; P122-L125 PolarHBondContact O-N 2.78Å
123	E	75.9	Confident	69.1	Low	130 Å²	130	124.5 Å²	124.5	61%	0.607	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-63.3	-17.1	175.3	63.7	-90	-157.6	0	0	114.1	H121	H121-E123 VanDerWaalsContact CB-CD 3.44Å; H121-E123 HydrophobicContact CB-CG 4.16Å; H121-E123 WeakPolarHBondContact CB-OE1 3.35Å; H121-E123 WeakPolarHBondContact CB-OE2 3.4Å; H121-E123 IonicContact CE1-OE1 3.92Å; H121-E123 IonicContact CG-OE1 3.38Å; H121-E123 IonicContact ND1-OE1 2.88Å; H121-E123 PolarHBondContact ND1-OE1 2.87Å; H121-E123 IonicContact ND1-OE2 3.75Å; H121-E123 PolarHBondContact O-N 3Å
124	W	76.3	Confident	69.1	Low	90 Å²	90	124 Å²	124	34%	0.341	62%	0.623	S	S	.	*	G	3₁₀ helix	trans	-82.5	-25.5	173.7	-59.9	-10.3	0	0	0	112.6	L104 F105 I119 H121 P122 S126	L104-W124 HydrophobicContact CD2-CD2 3.95Å; L104-W124 HydrophobicContact CD2-CE3 4.32Å; L104-W124 HydrophobicContact CD2-CG 4.1Å; L104-W124 HydrophobicContact CG-CD2 4.46Å; L104-W124 HydrophobicContact CG-CZ2 4.42Å; L104-W124 VanDerWaalsContact O-CH2 3.24Å; L104-W124 WeakPolarHBondContact O-CH2 3.43Å; L104-W124 WeakPolarHBondContact O-CZ2 3.24Å; F105-W124 HydrophobicContact CD1-CZ3 4.02Å; F105-W124 HydrophobicContact CE1-CE3 4.46Å; F105-W124 HydrophobicContact CE1-CZ3 4.14Å; I119-W124 VanDerWaalsContact O-CZ3 3.32Å; I119-W124 WeakPolarHBondContact O-CZ3 2.95Å; H121-W124 HydrophobicContact CB-CD2 3.72Å; H121-W124 HydrophobicContact CB-CE3 4.18Å; H121-W124 HydrophobicContact CB-CG 3.96Å; H121-W124 HydrophobicContact CB-CZ2 4.17Å; H121-W124 AromaticContact CD2-CH2 3.85Å; H121-W124 AromaticContact CD2-CZ2 3.73Å; H121-W124 WeakPolarHBondContact O-CB 3.48Å; H121-W124 PolarHBondContact O-N 2.83Å; P122-W124 PolarHBondContact O-N 3.07Å; P122-W124 VanDerWaalsContact O-N 3.15Å; W124-S126 VanDerWaalsContact C-N 3.34Å; W124-S126 PolarHBondContact O-N 3.31Å; W124-S126 VanDerWaalsContact O-N 3.14Å
125	L	71.1	Confident	68.9	Low	120 Å²	120	119.5 Å²	119.5	63%	0.628	62%	0.621	S	S	*	*	S	Bend	trans	-80.7	92.2	168	-57.2	178.1	0	0	0	105.4	P122 E127	P122-L125 CarbonylContact O-C 3.54Å; P122-L125 WeakPolarHBondContact O-CB 3.32Å; P122-L125 PolarHBondContact O-N 2.78Å; L125-E127 PolarHBondContact O-N 3.1Å
126	S	66.3	Low	68.7	Low	82 Å²	82	123.5 Å²	123.5	57%	0.573	63%	0.63	S	S	*	*			trans	-48.4	109.3	171.3	49	0	0	0	0	108.7	W124 T128	W124-S126 VanDerWaalsContact C-N 3.34Å; W124-S126 PolarHBondContact O-N 3.31Å; W124-S126 VanDerWaalsContact O-N 3.14Å; S126-T128 CarbonylContact O-C 3.51Å; S126-T128 PolarHBondContact O-N 3Å
127	E	64.2	Low	68.1	Low	197 Å²	197	124.6 Å²	124.6	92%	0.921	64%	0.639	S	S	*	*	S	Bend	trans	-55	-20.1	176.9	-74	-178.4	158.1	0	0	111.5	L125 M129	L125-E127 PolarHBondContact O-N 3.1Å; E127-M129 VanDerWaalsContact C-N 3.29Å; E127-M129 PolarHBondContact O-N 3.31Å
128	T	59.8	Low	67.8	Low	98 Å²	98	124 Å²	124	60%	0.601	65%	0.652	S	S	*	*	S	Bend	trans	-74.5	84.6	171.4	56	0	0	0	0	109.4	S126 T130	S126-T128 CarbonylContact O-C 3.51Å; S126-T128 PolarHBondContact O-N 3Å; T128-T130 WeakPolarHBondContact O-CG2 3.48Å; T128-T130 PolarHBondContact O-N 3.34Å
129	M	56.3	Low	67.4	Low	153 Å²	153	127.9 Å²	127.9	75%	0.754	67%	0.666	S	S	*	*			trans	-50.5	94	158.5	-173.1	162.3	155.5	0	0	107.9	E127 I131	E127-M129 VanDerWaalsContact C-N 3.29Å; E127-M129 PolarHBondContact O-N 3.31Å; M129-I131 HydrophobicContact CE-CD1 3.31Å; M129-I131 HydrophobicContact CE-CG1 4.13Å; M129-I131 HydrophobicContact CG-CB 4.44Å; M129-I131 HydrophobicContact CG-CD1 4.01Å; M129-I131 HydrophobicContact CG-CG1 3.77Å; M129-I131 PolarHBondContact O-N 2.76Å; M129-I131 HydrophobicContact SD-CD1 4.45Å
130	T	56.8	Low	67.1	Low	110 Å²	110	129 Å²	129	68%	0.675	68%	0.679	S	S	*	*			trans	-76	37.1	-179.9	52.3	0	0	0	0	111.1	T128 R132	T128-T130 WeakPolarHBondContact O-CG2 3.48Å; T128-T130 PolarHBondContact O-N 3.34Å; T130-R132 PolarHBondContact O-N 2.89Å
131	I	57.4	Low	67	Low	126 Å²	126	129.5 Å²	129.5	65%	0.646	69%	0.688	S	S	*	*			trans	-70.2	73.8	160.9	-52.9	-172.2	0	0	0	106.1	M129 Q133	M129-I131 HydrophobicContact CE-CD1 3.31Å; M129-I131 HydrophobicContact CE-CG1 4.13Å; M129-I131 HydrophobicContact CG-CB 4.44Å; M129-I131 HydrophobicContact CG-CD1 4.01Å; M129-I131 HydrophobicContact CG-CG1 3.77Å; M129-I131 PolarHBondContact O-N 2.76Å; M129-I131 HydrophobicContact SD-CD1 4.45Å; I131-Q133 PolarHBondContact O-N 3.31Å; I131-Q133 VanDerWaalsContact O-N 3.12Å
132	R	60.4	Low	66.9	Low	205 Å²	205	131.6 Å²	131.6	77%	0.774	71%	0.707	S	S	*	*			trans	-60.3	115.5	159.3	-55.9	-176.6	95.3	-155.5	6.4	102.8	T130 L134	T130-R132 PolarHBondContact O-N 2.89Å; R132-L134 PolarHBondContact O-N 3.36Å
133	Q	62.9	Low	67.1	Low	175 Å²	175	134.5 Å²	134.5	82%	0.818	72%	0.717	S	S	*	*			trans	-57	98.8	164.1	-175.2	177.1	8.9	0	0	105.3	I131 G135	I131-Q133 PolarHBondContact O-N 3.31Å; I131-Q133 VanDerWaalsContact O-N 3.12Å; Q133-G135 VanDerWaalsContact C-N 3.28Å; Q133-G135 PolarHBondContact O-N 3.13Å
134	L	62.5	Low	66.9	Low	145 Å²	145	133.6 Å²	133.6	76%	0.759	72%	0.722	S	S	*	*			trans	-61.6	105.7	166.5	-64.3	178.2	0	0	0	103.1	R132 L136	R132-L134 PolarHBondContact O-N 3.36Å; L134-L136 PolarHBondContact O-N 3.39Å; L134-L136 VanDerWaalsContact O-N 3.15Å
135	G	61	Low	66.5	Low	62 Å²	62	136.4 Å²	136.4	64%	0.639	74%	0.742	S	S	*	*			trans	-47.2	128.4	175.9	0	0	0	0	0	106.8	Q133 S137	Q133-G135 VanDerWaalsContact C-N 3.28Å; Q133-G135 PolarHBondContact O-N 3.13Å; G135-S137 VanDerWaalsContact C-N 3.33Å; G135-S137 PolarHBondContact O-N 2.96Å
136	L	64	Low	65.9	Low	165 Å²	165	136.6 Å²	136.6	86%	0.864	75%	0.749	S	S	*	*			trans	-56.3	104.3	179.5	-61	173.1	0	0	0	105.8	L134	L134-L136 PolarHBondContact O-N 3.39Å; L134-L136 VanDerWaalsContact O-N 3.15Å
137	S	64.5	Low	65.2	Low	100 Å²	100	139.6 Å²	139.6	70%	0.699	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-51.2	135	172.5	51.6	0	0	0	0	106.6	G135 R139	G135-S137 VanDerWaalsContact C-N 3.33Å; G135-S137 PolarHBondContact O-N 2.96Å; S137-R139 PolarHBondContact O-N 2.94Å
138	P	72.2	Confident	64	Low	122 Å²	122	133.4 Å²	133.4	79%	0.792	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-46.4	128.4	-176.5	-27.9	32.8	0	0	0	110.5
139	R	74.7	Confident	63.2	Low	230 Å²	230	136.4 Å²	136.4	87%	0.868	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-53.6	124.8	179	-177.3	174.9	-175.5	158.3	1.2	108.1	S137 T141	S137-R139 PolarHBondContact O-N 2.94Å; R139-T141 PolarHBondContact O-N 3.36Å
140	P	74.9	Confident	62.4	Low	114 Å²	114	136.7 Å²	136.7	74%	0.74	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-56.8	127.7	-179.5	18.3	-28.6	0	0	0	109.8
141	T	78.4	Confident	61.8	Low	129 Å²	129	138.7 Å²	138.7	79%	0.791	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-58.2	125	-179.9	-47.8	0	0	0	0	108.9	R139 L143	R139-T141 PolarHBondContact O-N 3.36Å; T141-L143 PolarHBondContact O-N 3.26Å
142	P	73	Confident	61.1	Low	114 Å²	114	139.7 Å²	139.7	74%	0.74	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-61.6	134.4	177.5	24.2	-31.3	0	0	0	109.6
143	L	75.9	Confident	60.3	Low	157 Å²	157	138.7 Å²	138.7	82%	0.822	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-58.8	141.6	176.3	-69.2	168.1	0	0	0	109.6	T141 I145	T141-L143 PolarHBondContact O-N 3.26Å; L143-I145 PolarHBondContact O-N 3.12Å
144	P	73.4	Confident	59.4	Low	111 Å²	111	135.5 Å²	135.5	72%	0.721	79%	0.785	S	S	*	*			trans	-59.7	115.5	175.5	24.8	-32.1	0	0	0	108.6	T146	P144-T146 VanDerWaalsContact C-N 3.33Å; P144-T146 PolarHBondContact O-N 3.46Å
145	I	66.4	Low	58.3	Low	149 Å²	149	134.8 Å²	134.8	76%	0.764	78%	0.782	S	S	*	*			trans	-65.4	99.3	164.9	17.3	173.4	0	0	0	106.3	L143 N147	L143-I145 PolarHBondContact O-N 3.12Å; I145-N147 VanDerWaalsContact C-N 3.25Å; I145-N147 PolarHBondContact O-N 2.87Å
146	T	59.5	Low	57.4	Low	124 Å²	124	141 Å²	141	76%	0.761	79%	0.791	S	S	*	*			trans	-68.7	92.8	167.4	57.8	0	0	0	0	106.5	P144 G148	P144-T146 VanDerWaalsContact C-N 3.33Å; P144-T146 PolarHBondContact O-N 3.46Å; T146-G148 PolarHBondContact O-N 3.19Å
147	N	51.9	Low	56.3	Low	145 Å²	145	143.9 Å²	143.9	78%	0.775	79%	0.79	S	S	*	*			trans	-64.3	91.9	160.9	-70.8	-13.6	0	0	0	105.7	I145 L149	I145-N147 VanDerWaalsContact C-N 3.25Å; I145-N147 PolarHBondContact O-N 2.87Å; N147-L149 VanDerWaalsContact C-N 3.31Å; N147-L149 PolarHBondContact O-N 3.15Å
148	G	38.1	Very low	55.2	Low	68 Å²	68	144.2 Å²	144.2	70%	0.701	79%	0.793	S	S	*	*			trans	-68.4	89.4	178.9	0	0	0	0	0	109.4	T146	T146-G148 PolarHBondContact O-N 3.19Å
149	L	43.3	Very low	53.8	Low	160 Å²	160	146.3 Å²	146.3	84%	0.838	79%	0.792	S	S	*	*			trans	-152.8	80.8	158.8	-74.8	-177.4	0	0	0	107.8	N147	N147-L149 VanDerWaalsContact C-N 3.31Å; N147-L149 PolarHBondContact O-N 3.15Å
150	N	40.2	Very low	52	Low	159 Å²	159	141.7 Å²	141.7	85%	0.85	79%	0.79	S	S	*	*			trans	-179.1	86.3	140.4	-96	-22.4	0	0	0	107.7	N152	N150-N152 PolarHBondContact O-N 3.41Å
151	D	43.3	Very low	50.5	Low	152 Å²	152	141.5 Å²	141.5	81%	0.813	79%	0.786	S	S	*	*			trans	-53.1	107.7	150.1	-64.9	-50.9	0	0	0	106.7
152	N	42.3	Very low	48.8	Very low	148 Å²	148	143.8 Å²	143.8	79%	0.791	79%	0.794	S	S	*	*			trans	151.5	76	159.4	-76.7	-34.4	0	0	0	109.1	N150	N150-N152 PolarHBondContact O-N 3.41Å
153	Q	42.8	Very low	47.2	Very low	183 Å²	183	142.6 Å²	142.6	86%	0.855	79%	0.788	S	S	*	*			trans	-175.4	67.8	137.1	-101	178.5	90.8	0	0	110.1	N155	Q153-N155 PolarHBondContact O-N 3.17Å
154	A	44.6	Very low	45.4	Very low	108 Å²	108	142.8 Å²	142.8	89%	0.893	79%	0.788	S	S	*	*			trans	-71.3	70.6	154.6	0	0	0	0	0	108.8
155	N	39.7	Very low	43.5	Very low	130 Å²	130	143.4 Å²	143.4	70%	0.695	79%	0.794	S	S	*	*			trans	-162.7	139.1	159.5	-136.3	-26.3	0	0	0	111.3	Q153	Q153-N155 PolarHBondContact O-N 3.17Å
156	K	42.7	Very low	42.1	Very low	192 Å²	192	142 Å²	142	84%	0.835	79%	0.794	S	S	*	*			trans	89.3	71.7	174.7	-50.3	-174.3	-176.7	-175.3	0	116.1
157	R	40.2	Very low	40.9	Very low	226 Å²	226	139.7 Å²	139.7	85%	0.853	80%	0.795	S	S	*	*			trans	-3.6	121.9	138.4	-100.9	173.5	170.3	178	-3.5	115.3	H159	R157-H159 PolarHBondContact O-N 3.02Å
158	S	42.6	Very low	40.2	Very low	108 Å²	108	138.1 Å²	138.1	76%	0.755	80%	0.796	S	S	*	*			trans	-35.5	103.3	159.4	48.1	0	0	0	0	114.3
159	H	42.2	Very low	40.4	Very low	165 Å²	165	139.5 Å²	139.5	76%	0.764	80%	0.795	S	S	*	*			trans	-102.3	103.1	152.2	-74.9	-72	0	0	0	107.8	R157 T161	R157-H159 PolarHBondContact O-N 3.02Å; H159-T161 PolarHBondContact O-N 2.78Å; H159-T161 VanDerWaalsContact O-N 3.15Å
160	T	37.1	Very low	40.4	Very low	134 Å²	134	143.1 Å²	143.1	82%	0.822	80%	0.797	S	S	*	*			trans	-56.8	103.3	163.9	50.1	0	0	0	0	108.9
161	T	43.8	Very low	40.5	Very low	110 Å²	110	145.3 Å²	145.3	68%	0.675	79%	0.794	S	S	*	*			trans	-131.8	114.4	166	57.3	0	0	0	0	109.1	H159 S163	H159-T161 PolarHBondContact O-N 2.78Å; H159-T161 VanDerWaalsContact O-N 3.15Å; T161-S163 PolarHBondContact O-N 3.18Å
162	N	42.7	Very low	40.4	Very low	176 Å²	176	145.5 Å²	145.5	94%	0.941	79%	0.794	S	S	*	*			trans	-60.8	101.8	168	-64	-41.1	0	0	0	107.4
163	S	39.3	Very low	40.3	Very low	90 Å²	90	144.9 Å²	144.9	63%	0.629	79%	0.789	S	S	*	*			trans	-125.5	100.7	171.3	57.4	0	0	0	0	109.4	T161 C165	T161-S163 PolarHBondContact O-N 3.18Å; S163-C165 PolarHBondContact O-N 3.28Å; S163-C165 VanDerWaalsContact O-N 3.14Å
164	I	37.8	Very low	40	Very low	161 Å²	161	141.3 Å²	141.3	83%	0.826	78%	0.783	S	S	*	*			trans	-36.1	113.1	156.6	-66.7	150.9	0	0	0	107.9	P166	I164-P166 WeakPolarHBondContact O-CD 3.49Å
165	C	32.6	Very low	39.7	Very low	123 Å²	123	141.6 Å²	141.6	83%	0.831	77%	0.773	S	S	*	*			trans	-54	106.9	-178.8	-62.9	0	0	0	0	110.3	S163	S163-C165 PolarHBondContact O-N 3.28Å; S163-C165 VanDerWaalsContact O-N 3.14Å
166	P	37.2	Very low	39.6	Very low	119 Å²	119	143.2 Å²	143.2	77%	0.773	78%	0.782	S	S	*	*			trans	-77.8	131.5	165.8	4.8	16.2	0	0	0	106.2	I164	I164-P166 WeakPolarHBondContact O-CD 3.49Å
167	G	35.1	Very low	39.3	Very low	76 Å²	76	137.7 Å²	137.7	78%	0.784	77%	0.767	S	S	*	*			trans	-57.4	160.6	-160.8	0	0	0	0	0	116.6
168	S	37.5	Very low	39.3	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	77%	0.772	S	S	*	*			trans	-175	95	145.7	167.3	0	0	0	0	109.6	R170	S168-R170 PolarHBondContact O-N 3.21Å
169	S	42.2	Very low	38.8	Very low	98 Å²	98	135.1 Å²	135.1	69%	0.685	77%	0.769	S	S	*	*			trans	36.9	73.1	130.3	-159.1	0	0	0	0	117.2
170	R	42.2	Very low	38.7	Very low	235 Å²	235	136.3 Å²	136.3	89%	0.887	78%	0.78	S	S	*	*			trans	-125.6	99.7	133.8	-71.4	-161	-178.2	-150.6	1.9	106.9	S168 N172	S168-R170 PolarHBondContact O-N 3.21Å; R170-N172 PolarHBondContact O-N 3.12Å
171	R	42.2	Very low	38.5	Very low	206 Å²	206	133 Å²	133	78%	0.777	77%	0.773	S	S	*	*			trans	-41.5	110.8	164.3	-71.7	172.6	-94.1	170.3	-5.6	107	M173	R171-M173 HydrophobicContact CB-CG 4.02Å; R171-M173 PolarHBondContact O-N 2.88Å
172	N	42.2	Very low	38.1	Very low	155 Å²	155	137 Å²	137	83%	0.829	78%	0.784	S	S	*	*			trans	-62.2	79.2	155.1	-77.6	-15.5	0	0	0	105.9	R170 C174	R170-N172 PolarHBondContact O-N 3.12Å; N172-C174 PolarHBondContact O-N 3.38Å; N172-C174 VanDerWaalsContact O-N 3.16Å
173	M	39.7	Very low	38.1	Very low	136 Å²	136	133.7 Å²	133.7	67%	0.67	77%	0.772	S	S	*	*			trans	-75.2	93.6	155.8	-63.1	-99.3	75.2	0	0	103	R171 T175	R171-M173 HydrophobicContact CB-CG 4.02Å; R171-M173 PolarHBondContact O-N 2.88Å; M173-T175 HydrophobicContact CB-CG2 4.37Å; M173-T175 PolarHBondContact O-N 3.31Å
174	C	37.1	Very low	38.3	Very low	108 Å²	108	133.4 Å²	133.4	73%	0.73	77%	0.77	S	S	*	*			trans	-59	89.7	154.5	-60.8	0	0	0	0	104.9	N172 D176	N172-C174 PolarHBondContact O-N 3.38Å; N172-C174 VanDerWaalsContact O-N 3.16Å; C174-D176 PolarHBondContact O-N 2.79Å
175	T	37.9	Very low	38.6	Very low	113 Å²	113	134.9 Å²	134.9	69%	0.693	77%	0.77	S	S	*	*			trans	-69.8	89.9	168.3	40.6	0	0	0	0	106.1	M173 S177	M173-T175 HydrophobicContact CB-CG2 4.37Å; M173-T175 PolarHBondContact O-N 3.31Å; T175-S177 PolarHBondContact O-N 2.87Å
176	D	38.3	Very low	39.3	Very low	165 Å²	165	136.5 Å²	136.5	88%	0.882	77%	0.771	S	S	*	*			trans	-62.4	74.3	153	-75.6	-31.8	0	0	0	107.6	C174	C174-D176 PolarHBondContact O-N 2.79Å
177	S	36.4	Very low	39.5	Very low	75 Å²	75	142.4 Å²	142.4	52%	0.524	78%	0.778	S	S	.	*			trans	-130.6	84	166.4	54.5	0	0	0	0	106.6	T175 S179	T175-S177 PolarHBondContact O-N 2.87Å; S177-S179 PolarHBondContact O-N 2.9Å
178	L	39.3	Very low	40.1	Very low	182 Å²	182	144.2 Å²	144.2	95%	0.953	78%	0.777	S	S	*	*			trans	-57.4	79.9	146.8	-75.6	162	0	0	0	106.7	L180	L178-L180 PolarHBondContact O-N 2.82Å
179	S	32.3	Very low	40.7	Very low	98 Å²	98	149.4 Å²	149.4	69%	0.685	78%	0.779	S	S	*	*			trans	-59.1	123.1	162.8	-67.8	0	0	0	0	107	S177 G181	S177-S179 PolarHBondContact O-N 2.9Å; S179-G181 VanDerWaalsContact C-N 3.35Å; S179-G181 PolarHBondContact O-N 3.16Å
180	L	40.2	Very low	41.3	Very low	191 Å²	191	150.3 Å²	150.3	100%	1	79%	0.786	S	S	*	*	S	Bend	trans	-59.1	92.4	178.4	-145.5	73.8	0	0	0	108.9	L178	L178-L180 PolarHBondContact O-N 2.82Å
181	G	32.8	Very low	41.8	Very low	65 Å²	65	145.7 Å²	145.7	67%	0.67	78%	0.778	S	S	*	*			trans	-171.1	108.4	-179.3	0	0	0	0	0	110.4	S179	S179-G181 VanDerWaalsContact C-N 3.35Å; S179-G181 PolarHBondContact O-N 3.16Å
182	Q	35.4	Very low	42.5	Very low	194 Å²	194	141.2 Å²	141.2	91%	0.907	78%	0.775	S	S	*	*			trans	-53.5	160.4	164.3	-71	-163.5	-34.9	0	0	111
183	P	43.2	Very low	43.3	Very low	106 Å²	106	139.8 Å²	139.8	69%	0.688	78%	0.775	S	S	*	*			cis	-141.4	171.1	21.8	35.5	-13.3	0	0	0	117.5
184	S	42.5	Very low	44.3	Very low	84 Å²	84	142.4 Å²	142.4	59%	0.587	78%	0.783	S	S	*	*			trans	70.9	106.2	144	48.5	0	0	0	0	121.8
185	F	44.3	Very low	45.4	Very low	191 Å²	191	142.9 Å²	142.9	84%	0.838	79%	0.787	S	S	*	*			trans	59.4	76.8	134.9	-47.8	-65.2	0	0	0	119.4
186	N	46.4	Very low	46.5	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	78%	0.778	S	S	*	*			trans	-137.3	71.1	140.9	-80.8	-47.2	0	0	0	108.7	C188	N186-C188 PolarHBondContact O-N 2.96Å
187	R	42.9	Very low	47.5	Very low	244 Å²	244	138.4 Å²	138.4	92%	0.921	76%	0.758	S	S	*	*			trans	-76.4	64	178.6	-161.6	-176.7	-157.6	-159.3	6	110.3	R189	R187-R189 VanDerWaalsContact C-N 3.28Å; R187-R189 PolarHBondContact O-N 2.77Å; R187-R189 VanDerWaalsContact O-N 3.12Å
188	C	46.8	Very low	48.8	Very low	113 Å²	113	139.6 Å²	139.6	76%	0.764	76%	0.764	S	S	*	*			trans	-84.7	68.6	171.4	-67.5	0	0	0	0	110.2	N186	N186-C188 PolarHBondContact O-N 2.96Å
189	R	50.8	Low	50	Low	221 Å²	221	137.7 Å²	137.7	83%	0.834	75%	0.753	S	S	*	*			trans	-151.3	60.6	165.9	-67.1	-165.5	-174.7	-163.5	2.2	111.4	R187 L191	R187-R189 VanDerWaalsContact C-N 3.28Å; R187-R189 PolarHBondContact O-N 2.77Å; R187-R189 VanDerWaalsContact O-N 3.12Å; R189-L191 PolarHBondContact O-N 3.03Å
190	S	54.3	Low	51.1	Low	118 Å²	118	135.1 Å²	135.1	83%	0.825	73%	0.733	S	S	*	*			trans	-79.2	99.2	153.8	55.4	0	0	0	0	106.4
191	L	53.2	Low	52	Low	137 Å²	137	135.9 Å²	135.9	72%	0.717	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-48	144	166.9	-85	78.8	0	0	0	108.6	R189	R189-L191 PolarHBondContact O-N 3.03Å
192	P	56.3	Low	52.9	Low	112 Å²	112	137.5 Å²	137.5	73%	0.727	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-53.4	136.2	174.1	22.8	-31.8	0	0	0	108.8	K194	P192-K194 PolarHBondContact O-N 3.14Å; P192-K194 VanDerWaalsContact O-N 3.17Å
193	P	59.9	Low	54	Low	126 Å²	126	132.8 Å²	132.8	82%	0.818	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-52.6	128.2	178.7	18.9	-29.2	0	0	0	108.8	S195	P193-S195 PolarHBondContact O-N 2.88Å
194	K	59.7	Low	54.5	Low	191 Å²	191	137.6 Å²	137.6	83%	0.83	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-53.4	129.3	-178.7	-67.7	177	-179.8	175.2	0	108	P192 I196	P192-K194 PolarHBondContact O-N 3.14Å; P192-K194 VanDerWaalsContact O-N 3.17Å; K194-I196 PolarHBondContact O-N 3.01Å
195	S	60.3	Low	54.8	Low	118 Å²	118	136.6 Å²	136.6	83%	0.825	71%	0.714	S	S	*	*			trans	-55.3	112.6	-178.1	53.9	0	0	0	0	109.8	P193 N197	P193-S195 PolarHBondContact O-N 2.88Å; S195-N197 PolarHBondContact O-N 2.93Å
196	I	61.9	Low	54.7	Low	99 Å²	99	135.5 Å²	135.5	51%	0.508	72%	0.716	S	S	.	*			trans	-63.8	124.5	167.4	-76	164.9	0	0	0	106.8	K194 P198	K194-I196 PolarHBondContact O-N 3.01Å; I196-P198 WeakPolarHBondContact O-CD 3.35Å
197	N	58.2	Low	54.5	Low	84 Å²	84	135.3 Å²	135.3	45%	0.449	72%	0.716	S	S	.	*			trans	-69.6	115.6	170.5	-175.8	-10.9	0	0	0	107.3	S195 I199 T200	S195-N197 PolarHBondContact O-N 2.93Å; N197-I199 PolarHBondContact O-N 2.98Å; N197-I199 PolarHBondContact OD1-N 3.21Å; N197-T200 CarbonylContact O-C 3.25Å; N197-T200 VanDerWaalsContact O-C 3.25Å; N197-T200 PolarHBondContact O-N 3.15Å; N197-T200 VanDerWaalsContact O-N 3.1Å
198	P	64.5	Low	54.7	Low	101 Å²	101	133 Å²	133	66%	0.656	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-14.5	-174.2	25.8	-34.8	0	0	0	113.5	I196	I196-P198 WeakPolarHBondContact O-CD 3.35Å
199	I	63.4	Low	55.1	Low	141 Å²	141	134 Å²	134	72%	0.723	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-34.6	179	-59.1	173.4	0	0	0	111.2	N197	N197-I199 PolarHBondContact O-N 2.98Å; N197-I199 PolarHBondContact OD1-N 3.21Å
200	T	57	Low	55.3	Low	44 Å²	44	129.4 Å²	129.4	27%	0.27	73%	0.725	S	S	.	*			trans	-122.4	99.2	-179.7	55.5	0	0	0	0	106.7	N197 D202	N197-T200 CarbonylContact O-C 3.25Å; N197-T200 VanDerWaalsContact O-C 3.25Å; N197-T200 PolarHBondContact O-N 3.15Å; N197-T200 VanDerWaalsContact O-N 3.1Å; T200-D202 WeakPolarHBondContact CB-OD2 2.98Å; T200-D202 PolarHBondContact O-N 2.92Å
201	W	58.4	Low	55.4	Low	207 Å²	207	130.1 Å²	130.1	78%	0.784	72%	0.72	S	S	*	*			trans	-61.2	10	172.9	-65.2	90.9	0	0	0	113.5	S203	W201-S203 PolarHBondContact O-N 2.84Å
202	D	51.8	Low	55.5	Low	99 Å²	99	129.6 Å²	129.6	53%	0.529	72%	0.72	S	S	.	*			trans	-58.6	96.7	171.8	-60.4	-27.4	0	0	0	109.2	T200 Y204	T200-D202 WeakPolarHBondContact CB-OD2 2.98Å; T200-D202 PolarHBondContact O-N 2.92Å; D202-Y204 VanDerWaalsContact C-N 3.33Å; D202-Y204 HydrophobicContact CB-CD2 4.48Å; D202-Y204 HydrophobicContact CB-CE2 4.22Å; D202-Y204 PolarHBondContact O-N 3.18Å
203	S	58.6	Low	55.5	Low	95 Å²	95	130.8 Å²	130.8	66%	0.664	72%	0.719	S	S	*	*			trans	-73	94.5	164.6	-62.5	0	0	0	0	106.3	W201 G205	W201-S203 PolarHBondContact O-N 2.84Å; S203-G205 PolarHBondContact O-N 3.05Å
204	Y	53.4	Low	55.2	Low	207 Å²	207	131.1 Å²	131.1	81%	0.812	71%	0.713	S	S	*	*			trans	-63	102.8	174.5	-76.9	-88.5	0	0	0	109.3	D202	D202-Y204 VanDerWaalsContact C-N 3.33Å; D202-Y204 HydrophobicContact CB-CD2 4.48Å; D202-Y204 HydrophobicContact CB-CE2 4.22Å; D202-Y204 PolarHBondContact O-N 3.18Å
205	G	48.7	Very low	54.8	Low	63 Å²	63	126.8 Å²	126.8	65%	0.649	70%	0.704	S	S	*	*			trans	149.5	59.5	165.3	0	0	0	0	0	115.6	S203 N207	S203-G205 PolarHBondContact O-N 3.05Å; G205-N207 PolarHBondContact O-N 2.95Å
206	N	43.1	Very low	54.4	Low	168 Å²	168	127.5 Å²	127.5	90%	0.898	70%	0.695	S	S	*	*			trans	-80	96.1	144	-73.5	-31.4	0	0	0	105.9
207	N	41.8	Very low	53.8	Low	154 Å²	154	129.8 Å²	129.8	82%	0.824	71%	0.71	S	S	*	*			trans	-75.9	134.7	162	-97.3	-10.9	0	0	0	107.6	G205	G205-N207 PolarHBondContact O-N 2.95Å
208	P	46.7	Very low	53.4	Low	195 Å²	195	134 Å²	134	100%	1.266	73%	0.734	S	S	*	*			trans	-65.7	0	179.3	29.5	-35.6	0	0	0	113.1

Retrieved 208 of 208 residues in 38.9 ms (Link to these results)

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